N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide

C22H21N3O2 — CID 109210842

IUPACN-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cc(NC(C)c3ccccc3)ccn2)cc1
InChIInChI=1S/C22H21N3O2/c1-15(17-6-4-3-5-7-17)24-20-12-13-23-21(14-20)22(27)25-19-10-8-18(9-11-19)16(2)26/h3-15H,1-2H3,(H,23,24)(H,25,27)
InChIKeyMFJDIAWILVMZOC-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.71
Rot. Bonds6

About N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide

N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide (PubChem CID 109210842) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide
PubChem CID109210842
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC NameN-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cc(NC(C)c3ccccc3)ccn2)cc1
InChIInChI=1S/C22H21N3O2/c1-15(17-6-4-3-5-7-17)24-20-12-13-23-21(14-20)22(27)25-19-10-8-18(9-11-19)16(2)26/h3-15H,1-2H3,(H,23,24)(H,25,27)
InChIKeyMFJDIAWILVMZOC-UHFFFAOYSA-N
XLogP4.71
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(4-acetylphenyl)-4-N-(1-phenylethyl)pyridine-2,4-dicarboxamide
CID 109086071
N-(4-ethoxyphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide
CID 109210831
N-(2-methylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide
CID 109210797
N-(2,6-dimethylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide
CID 109210807
4-(4-acetylanilino)-N-(4-acetylphenyl)pyridine-2-carboxamide
CID 109222150
N-(2-methoxyphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide
CID 109210827
4-(1-phenylethylamino)-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 109210872
N-(4-acetylphenyl)-4-(2-methylanilino)pyridine-2-carboxamide
CID 109219035
4-(butan-2-ylamino)-N-phenylpyridine-2-carboxamide
CID 109203508
N-[(2-chlorophenyl)methyl]-4-(1-phenylethylamino)pyridine-2-carboxamide
CID 109210753
N-(4-phenoxyphenyl)-4-(propan-2-ylamino)pyridine-2-carboxamide
CID 109201642
N-(4-acetylphenyl)-4-aminopyridine-2-carboxamide
CID 82299178

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide (CID 109210842) is N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide is CC(=O)c1ccc(NC(=O)c2cc(NC(C)c3ccccc3)ccn2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide?
The InChIKey is MFJDIAWILVMZOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c1-15(17-6-4-3-5-7-17)24-20-12-13-23-21(14-20)22(27)25-19-10-8-18(9-11-19)16(2)26/h3-15H,1-2H3,(H,23,24)(H,25,27).
What are the key properties of N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide?
N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide has a molecular weight of 359.43 g/mol, XLogP of 4.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109210842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).