Molecule

ID:18486

General Information
Structure
MolImage
Molecular Formula
C₉H₁₇N
Molecular Mass
139.23798
Exact Mass
139.13609955
Charge
0
InChI
InChI=1S/C9H17N/c1-6(10)9-5-7-2-3-8(9)4-7/h6-9H,2-5,10H2,1H3
InChIKey
LPUCHTNHUHOTRY-UHFFFAOYSA-N
Canonic Smiles
CC(C1CC2CC1CC2)N
Isomeric Smiles
C1(C2CC(C1)CC2)C(N)C
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-1.4567096
LogD (pH = 7.4)
-1.1679745
Log P
1.571143
Molar Refractivity
42.7766
Polarizability
17.397926
Polar Surface Area
26.02
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
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
Bioactivity
Navigation