Molecule

ID:74501

General Information
Structure
MolImage
Molecular Formula
C₅H₁₁NO
Molecular Mass
101.14694
Exact Mass
101.08406398
Charge
0
InChI
InChI=1S/C5H11NO/c1-4-5(7)6(2)3/h4H2,1-3H3
InChIKey
MBHINSULENHCMF-UHFFFAOYSA-N
Canonic Smiles
CCC(=O)N(C)C
Isomeric Smiles
O=C(N(C)C)CC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.11759937
LogD (pH = 7.4)
0.117599644
Log P
0.11759965
Molar Refractivity
28.8862
Polarizability
11.1500025
Polar Surface Area
20.31
Rotatable Bonds
1
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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