N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide

C19H21N3O2 — CID 109204307

IUPACN-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cc(NC3CCCC3)ccn2)c1
InChIInChI=1S/C19H21N3O2/c1-13(23)14-5-4-8-16(11-14)22-19(24)18-12-17(9-10-20-18)21-15-6-2-3-7-15/h4-5,8-12,15H,2-3,6-7H2,1H3,(H,20,21)(H,22,24)
InChIKeyPGZQDYBJCYFDPP-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.89
Rot. Bonds5

About N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide

N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide (PubChem CID 109204307) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide
PubChem CID109204307
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cc(NC3CCCC3)ccn2)c1
InChIInChI=1S/C19H21N3O2/c1-13(23)14-5-4-8-16(11-14)22-19(24)18-12-17(9-10-20-18)21-15-6-2-3-7-15/h4-5,8-12,15H,2-3,6-7H2,1H3,(H,20,21)(H,22,24)
InChIKeyPGZQDYBJCYFDPP-UHFFFAOYSA-N
XLogP3.89
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamidophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide
CID 109202020
2-N-(3-acetylphenyl)-4-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080814
N-(3-acetylphenyl)-2-(cyclohexylamino)pyrimidine-4-carboxamide
CID 109298721
4-N-(3-acetylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080981
N-(3-acetylphenyl)-4-anilinopyridine-2-carboxamide
CID 109218881
N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226944
4-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 109205065
2-N-(3-acetylphenyl)-6-N-cyclohexylpyridine-2,6-dicarboxamide
CID 109095376
N-(3-acetylphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203933
N-(4-bromophenyl)-4-(cycloheptylamino)pyridine-2-carboxamide
CID 109217159
4-(3-acetylanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109220749
2-N-(3-acetylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090859

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide (CID 109204307) is N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide is CC(=O)c1cccc(NC(=O)c2cc(NC3CCCC3)ccn2)c1.
What is the InChIKey of N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide?
The InChIKey is PGZQDYBJCYFDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-13(23)14-5-4-8-16(11-14)22-19(24)18-12-17(9-10-20-18)21-15-6-2-3-7-15/h4-5,8-12,15H,2-3,6-7H2,1H3,(H,20,21)(H,22,24).
What are the key properties of N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide?
N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 3.89, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109204307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).