3-amino-N-(1-cyclohexylethyl)benzamide

C15H22N2O — CID 62404995

IUPAC3-amino-N-(1-cyclohexylethyl)benzamide
SMILESCC(NC(=O)c1cccc(N)c1)C1CCCCC1
InChIInChI=1S/C15H22N2O/c1-11(12-6-3-2-4-7-12)17-15(18)13-8-5-9-14(16)10-13/h5,8-12H,2-4,6-7,16H2,1H3,(H,17,18)
InChIKeyOITADNUWRXJMBI-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.97
Rot. Bonds3

About 3-amino-N-(1-cyclohexylethyl)benzamide

3-amino-N-(1-cyclohexylethyl)benzamide (PubChem CID 62404995) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-amino-N-(1-cyclohexylethyl)benzamide.

Molecular Properties

Compound Name3-amino-N-(1-cyclohexylethyl)benzamide
PubChem CID62404995
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-amino-N-(1-cyclohexylethyl)benzamide
SMILESCC(NC(=O)c1cccc(N)c1)C1CCCCC1
InChIInChI=1S/C15H22N2O/c1-11(12-6-3-2-4-7-12)17-15(18)13-8-5-9-14(16)10-13/h5,8-12H,2-4,6-7,16H2,1H3,(H,17,18)
InChIKeyOITADNUWRXJMBI-UHFFFAOYSA-N
XLogP2.97
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-amino-N-(1-cyclohexylethyl)benzamide 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

3-(aminomethyl)-N-(1-cyclohexylethyl)benzamide
CID 55069258
4-amino-N-(1-cyclopentylethyl)benzamide;hydrochloride
CID 119782446
1-(3-aminophenyl)-3-(1-cyclohexylethyl)urea
CID 55069368
N-[(1S)-1-cyclohexylethyl]-3-[(2S,3R)-2,3-diphenylcyclopropanecarbonyl]benzamide
CID 101168952
3-amino-4-chloro-N-[(1R)-1-cycloheptylethyl]benzamide
CID 81392061
4-amino-3-bromo-N-[(1R)-1-cycloheptylethyl]benzamide
CID 81392320
N-[(1S)-1-cyclohexylethyl]-2-[4-[[(1S)-1-cyclohexylethyl]carbamoyl]-2-pyridinyl]pyridine-4-carboxamide
CID 132516828
3,5-diamino-N-(1-cyclopropylethyl)benzamide
CID 61094229
methyl (2R)-2-[(3-aminobenzoyl)amino]-3-cyclohexylpropanoate
CID 91059874
4-amino-N-[(1S)-1-cyclopentylethyl]-3-fluorobenzamide
CID 81389087
4-amino-3-chloro-N-[(1S)-1-cyclopentylethyl]benzamide
CID 81388850
N-[(1S)-1-cyclohexylethyl]-4-[4-[[(1S)-1-cyclohexylethyl]carbamoyl]phenyl]benzamide
CID 132596984

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-cyclohexylethyl)benzamide?
The IUPAC name of 3-amino-N-(1-cyclohexylethyl)benzamide (CID 62404995) is 3-amino-N-(1-cyclohexylethyl)benzamide.
What is the SMILES notation for 3-amino-N-(1-cyclohexylethyl)benzamide?
The canonical SMILES for 3-amino-N-(1-cyclohexylethyl)benzamide is CC(NC(=O)c1cccc(N)c1)C1CCCCC1.
What is the InChIKey of 3-amino-N-(1-cyclohexylethyl)benzamide?
The InChIKey is OITADNUWRXJMBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11(12-6-3-2-4-7-12)17-15(18)13-8-5-9-14(16)10-13/h5,8-12H,2-4,6-7,16H2,1H3,(H,17,18).
What are the key properties of 3-amino-N-(1-cyclohexylethyl)benzamide?
3-amino-N-(1-cyclohexylethyl)benzamide has a molecular weight of 246.35 g/mol, XLogP of 2.97, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-cyclohexylethyl)benzamide is sourced from PubChem (CID 62404995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).