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Molecule
ID:58154
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₀H₁₉N
Molecular Mass
153.26456
Exact Mass
153.15174961
Charge
0
InChI
InChI=1S/C10H19N/c1-2-4-6-10(5-3-1)7-8-11-9-10/h11H,1-9H2
InChIKey
UYUUEEXDJGLCLY-UHFFFAOYSA-N
Canonic Smiles
C1CCCC2(CC1)CNCC2
Isomeric Smiles
C12(CCNC1)CCCCCC2
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.97037685
LogD (pH = 7.4)
-0.8850978
Log P
2.2704415
Molar Refractivity
47.7059
Polarizability
19.244478
Polar Surface Area
12.03
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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General Information
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RDKit
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Physical Property
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Molecular Spectra
Molecule Details
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Commercial Catalog
Matrix Scientific
063331
ChemBridge
4044842
Enamine
EN300-101850
Academic Data
PubChem
23282818
Names and Identifiers
IUPAC name
2-azaspiro[4.6]undecane
Synonyms
2-Azaspiro[4.6]undecane
IUPAC Traditional name
2-azaspiro[4.6]undecane
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay
Properties
Safety Information
MSDS Link
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Source
TSCA Listed
false
Source
Storage Warning
IRRITANT
Source
Product Information
Purity
95%
Source
Physical Property
2.926
Source
Hydrophobicity(logP)
Registration numbers
MDL Number
MFCD06808629
PubChem CID
23282818
PubChem SID
162062917
CAS Number
184-14-5
Related Proteins
Related Proteins
Registration numbers
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