7-amino-N-benzyl-N-cyclohexylheptanamide

C20H32N2O — CID 119729560

IUPAC7-amino-N-benzyl-N-cyclohexylheptanamide
SMILESNCCCCCCC(=O)N(Cc1ccccc1)C1CCCCC1
InChIInChI=1S/C20H32N2O/c21-16-10-2-1-9-15-20(23)22(19-13-7-4-8-14-19)17-18-11-5-3-6-12-18/h3,5-6,11-12,19H,1-2,4,7-10,13-17,21H2
InChIKeyGHOOMCXGYZSEMI-UHFFFAOYSA-N
MW316.49 g/mol
LogP4.26
Rot. Bonds9

About 7-amino-N-benzyl-N-cyclohexylheptanamide

7-amino-N-benzyl-N-cyclohexylheptanamide (PubChem CID 119729560) has the molecular formula C20H32N2O and a molecular weight of 316.49 g/mol. Its IUPAC name is 7-amino-N-benzyl-N-cyclohexylheptanamide.

Molecular Properties

Compound Name7-amino-N-benzyl-N-cyclohexylheptanamide
PubChem CID119729560
Molecular FormulaC20H32N2O
Molecular Weight316.49 g/mol
Exact Mass316.25
IUPAC Name7-amino-N-benzyl-N-cyclohexylheptanamide
SMILESNCCCCCCC(=O)N(Cc1ccccc1)C1CCCCC1
InChIInChI=1S/C20H32N2O/c21-16-10-2-1-9-15-20(23)22(19-13-7-4-8-14-19)17-18-11-5-3-6-12-18/h3,5-6,11-12,19H,1-2,4,7-10,13-17,21H2
InChIKeyGHOOMCXGYZSEMI-UHFFFAOYSA-N
XLogP4.26
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.49
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 7-amino-N-benzyl-N-cyclohexylheptanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-amino-N-benzyl-N-cyclopropylhexanamide
CID 43579228
3-amino-N-benzyl-N-cycloheptylpropanamide
CID 39373340
6-amino-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]hexanamide
CID 60964131
N-(3-aminopropyl)-N-cyclobutyl-3-phenylpropanamide
CID 102873861
4-amino-N-cyclopropyl-N-[(4-ethylphenyl)methyl]butanamide
CID 54870516
4-amino-N-cyclopropyl-N-(pyridin-3-ylmethyl)butanamide
CID 54869888
N-(2-chloroethyl)-N-cyclohexyl-4-phenylbutanamide
CID 63391462
N-benzyl-N-cyclohexyl-2-(4-methoxycyclohexyl)acetamide
CID 166186727
6-[cyclopropyl(pyridin-4-ylmethyl)amino]-6-oxohexanoic acid
CID 60953865
7-amino-N-cycloheptyl-N-methylheptanamide
CID 43614064
7-amino-N-cyclooctyl-N-methylheptanamide
CID 119763844
4-amino-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]butanamide
CID 54869898

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-benzyl-N-cyclohexylheptanamide?
The IUPAC name of 7-amino-N-benzyl-N-cyclohexylheptanamide (CID 119729560) is 7-amino-N-benzyl-N-cyclohexylheptanamide.
What is the SMILES notation for 7-amino-N-benzyl-N-cyclohexylheptanamide?
The canonical SMILES for 7-amino-N-benzyl-N-cyclohexylheptanamide is NCCCCCCC(=O)N(Cc1ccccc1)C1CCCCC1.
What is the InChIKey of 7-amino-N-benzyl-N-cyclohexylheptanamide?
The InChIKey is GHOOMCXGYZSEMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O/c21-16-10-2-1-9-15-20(23)22(19-13-7-4-8-14-19)17-18-11-5-3-6-12-18/h3,5-6,11-12,19H,1-2,4,7-10,13-17,21H2.
What are the key properties of 7-amino-N-benzyl-N-cyclohexylheptanamide?
7-amino-N-benzyl-N-cyclohexylheptanamide has a molecular weight of 316.49 g/mol, XLogP of 4.26, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-benzyl-N-cyclohexylheptanamide is sourced from PubChem (CID 119729560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).