N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide

C20H25N3O — CID 119590618

IUPACN-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide
SMILESNCC(NC(=O)c1cncc(-c2ccccc2)c1)C1CCCCC1
InChIInChI=1S/C20H25N3O/c21-12-19(16-9-5-2-6-10-16)23-20(24)18-11-17(13-22-14-18)15-7-3-1-4-8-15/h1,3-4,7-8,11,13-14,16,19H,2,5-6,9-10,12,21H2,(H,23,24)
InChIKeyBBMMXGBMQJULAX-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.39
Rot. Bonds5

About N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide

N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide (PubChem CID 119590618) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide
PubChem CID119590618
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC NameN-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide
SMILESNCC(NC(=O)c1cncc(-c2ccccc2)c1)C1CCCCC1
InChIInChI=1S/C20H25N3O/c21-12-19(16-9-5-2-6-10-16)23-20(24)18-11-17(13-22-14-18)15-7-3-1-4-8-15/h1,3-4,7-8,11,13-14,16,19H,2,5-6,9-10,12,21H2,(H,23,24)
InChIKeyBBMMXGBMQJULAX-UHFFFAOYSA-N
XLogP3.39
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide 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

N-(2-amino-1-cyclohexylethyl)-5-methylpyridine-3-carboxamide
CID 81486901
N-(2-amino-1-cyclohexylethyl)-5-fluoropyridine-3-carboxamide;dihydrochloride
CID 119589722
N-(2-amino-1-cyclopentylethyl)-5-bromopyridine-3-carboxamide
CID 106737450
N-(2-amino-1-cyclopentylethyl)pyridine-3-carboxamide
CID 106737538
3-[(2-amino-1-cyclohexylethyl)carbamoyl]benzoic acid
CID 122153095
N-(2-amino-1-cyclohexylethyl)-5-phenyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 119589991
N-(2-amino-1-cyclohexylethyl)-3,4-dichlorobenzamide
CID 81486899
N-cyclopropyl-5-(4-phenylphenyl)pyridine-3-carboxamide
CID 42845850
N-(2-amino-1-cyclohexylethyl)-2-iodobenzamide
CID 81487660
N-(2-amino-1-cyclohexylethyl)-3-(2-methyl-1,3-thiazol-4-yl)benzamide;dihydrochloride
CID 119591379
N-(2-amino-1-cyclohexylethyl)-3,5-dibromobenzamide
CID 107973523
N-(2-amino-1-cyclohexylethyl)-1H-imidazole-5-carboxamide
CID 113283771

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide (CID 119590618) is N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide is NCC(NC(=O)c1cncc(-c2ccccc2)c1)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide?
The InChIKey is BBMMXGBMQJULAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c21-12-19(16-9-5-2-6-10-16)23-20(24)18-11-17(13-22-14-18)15-7-3-1-4-8-15/h1,3-4,7-8,11,13-14,16,19H,2,5-6,9-10,12,21H2,(H,23,24).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide?
N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-5-phenylpyridine-3-carboxamide is sourced from PubChem (CID 119590618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).