Molfinder
Home
Support
About Us
Data Source
Statistics
Blogs
Molecule
ID:24459
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₁H₂₄N₂
Molecular Mass
184.32166
Exact Mass
184.19394878
Charge
0
InChI
InChI=1S/C11H24N2/c1-2-12-9-6-10-13-11-7-4-3-5-8-11/h11-13H,2-10H2,1H3
InChIKey
YOFALYLASSEFDO-UHFFFAOYSA-N
Canonic Smiles
CCNCCCNC1CCCCC1
Isomeric Smiles
N(C1CCCCC1)CCCNCC
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-4.53986
LogD (pH = 7.4)
-2.8257093
Log P
1.6587564
Molar Refractivity
58.046
Polarizability
23.35114
Polar Surface Area
24.06
Rotatable Bonds
6
Lipinski's Rule of Five
true
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
Loading...
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Loading...
Bioactivity
Loading...
Quote
Download
Navigation
General Information
Calculated Properties
•
RDKit
•
JChem
Data Source
•
Commercial Catalog
•
Academic Data
Names and Identifiers
•
IUPAC Traditional name
•
IUPAC name
•
Synonyms
Registration numbers
•
PubChem CID
•
PubChem SID
•
MDL Number
Properties
•
Safety Information
Related Proteins
Molecular Spectra
Molecule Details
References
•
PubChem Literature
•
From Data Sources
Bioactivity
•
PubChem BioAssay
Data Source
Commercial Catalog
Matrix Scientific
026964
Academic Data
PubChem
11458103
Names and Identifiers
IUPAC Traditional name
[3-(cyclohexylamino)propyl](ethyl)amine
IUPAC name
[3-(cyclohexylamino)propyl](ethyl)amine
Synonyms
N1-Cyclohexyl-N3-ethyl-1,3-propanediamine
Registration numbers
PubChem CID
11458103
PubChem SID
160987766
MDL Number
MFCD10687346
Properties
Safety Information
Storage Warning
IRRITANT
Source
TSCA Listed
false
Source
MSDS Link
Download link
Source
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay