2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide

C20H24N2O — CID 70620983

IUPAC2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide
SMILESCc1ccc(N(C(=O)C2CCCCC2N)c2ccccc2)cc1
InChIInChI=1S/C20H24N2O/c1-15-11-13-17(14-12-15)22(16-7-3-2-4-8-16)20(23)18-9-5-6-10-19(18)21/h2-4,7-8,11-14,18-19H,5-6,9-10,21H2,1H3
InChIKeyNFHPZZMQQSSZDE-UHFFFAOYSA-N
MW308.43 g/mol
LogP4.18
Rot. Bonds3

About 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide

2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide (PubChem CID 70620983) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide
PubChem CID70620983
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide
SMILESCc1ccc(N(C(=O)C2CCCCC2N)c2ccccc2)cc1
InChIInChI=1S/C20H24N2O/c1-15-11-13-17(14-12-15)22(16-7-3-2-4-8-16)20(23)18-9-5-6-10-19(18)21/h2-4,7-8,11-14,18-19H,5-6,9-10,21H2,1H3
InChIKeyNFHPZZMQQSSZDE-UHFFFAOYSA-N
XLogP4.18
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide (CID 70620983) is 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide is Cc1ccc(N(C(=O)C2CCCCC2N)c2ccccc2)cc1.
What is the InChIKey of 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide?
The InChIKey is NFHPZZMQQSSZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-15-11-13-17(14-12-15)22(16-7-3-2-4-8-16)20(23)18-9-5-6-10-19(18)21/h2-4,7-8,11-14,18-19H,5-6,9-10,21H2,1H3.
What are the key properties of 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide?
2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide has a molecular weight of 308.43 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide is sourced from PubChem (CID 70620983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).