Molecule

ID:85755

General Information
Structure
MolImage
Molecular Formula
C₇H₁₄N₂O
Molecular Mass
142.19886
Exact Mass
142.11061308
Charge
0
InChI
InChI=1S/C7H14N2O/c8-4-2-6-9-5-1-3-7(9)10/h1-6,8H2
InChIKey
HJORCZCMNWLHMB-UHFFFAOYSA-N
Canonic Smiles
NCCCN1CCCC1=O
Isomeric Smiles
N1(CCCN)CCCC1=O
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-4.101477
LogD (pH = 7.4)
-3.377172
Log P
-1.0929573
Molar Refractivity
39.9698
Polarizability
15.631624
Polar Surface Area
46.33
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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