1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide

C21H22N4O4S — CID 75373447

IUPAC1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide
SMILESCC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccc4nccn34)CC2)c1
InChIInChI=1S/C21H22N4O4S/c1-15(26)17-4-2-5-18(14-17)30(28,29)24-11-8-16(9-12-24)21(27)23-20-7-3-6-19-22-10-13-25(19)20/h2-7,10,13-14,16H,8-9,11-12H2,1H3,(H,23,27)
InChIKeyYEJCQJSXJODBHX-UHFFFAOYSA-N
MW426.50 g/mol
LogP2.58
Rot. Bonds5

About 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide

1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide (PubChem CID 75373447) has the molecular formula C21H22N4O4S and a molecular weight of 426.50 g/mol. Its IUPAC name is 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide
PubChem CID75373447
Molecular FormulaC21H22N4O4S
Molecular Weight426.50 g/mol
Exact Mass426.14
IUPAC Name1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide
SMILESCC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccc4nccn34)CC2)c1
InChIInChI=1S/C21H22N4O4S/c1-15(26)17-4-2-5-18(14-17)30(28,29)24-11-8-16(9-12-24)21(27)23-20-7-3-6-19-22-10-13-25(19)20/h2-7,10,13-14,16H,8-9,11-12H2,1H3,(H,23,27)
InChIKeyYEJCQJSXJODBHX-UHFFFAOYSA-N
XLogP2.58
TPSA100.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.50
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-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

1-(3-acetylphenyl)sulfonyl-N-quinolin-8-ylpiperidine-4-carboxamide
CID 26123306
1-(3-acetylphenyl)sulfonyl-N-(3-chloro-2-methylphenyl)piperidine-4-carboxamide
CID 26115202
1-(3-acetylphenyl)sulfonyl-N-[3-(hydroxymethyl)phenyl]piperidine-4-carboxamide
CID 9299938
1-(3-acetylphenyl)sulfonyl-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 8714129
1-(3-acetylphenyl)sulfonyl-N-[(1R,2S)-2-methylcyclohexyl]piperidine-4-carboxamide
CID 9404010
1-(3-acetylphenyl)sulfonyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-4-carboxamide
CID 24573053
1-(3-acetylphenyl)sulfonyl-N-benzhydrylpiperidine-4-carboxamide
CID 26735300
1-(3-acetylphenyl)sulfonyl-N-(1-ethylpiperidin-4-yl)piperidine-4-carboxamide
CID 9091183
N-(3-acetylphenyl)-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide
CID 34830036
1-(3-acetylphenyl)sulfonyl-N-[(1R)-1-(furan-2-yl)ethyl]piperidine-4-carboxamide
CID 9482139
N-(3-acetylphenyl)-1-(4-bromophenyl)sulfonylpiperidine-4-carboxamide
CID 1327585
N-(3-acetylphenyl)-1-(3-chloro-4-fluorophenyl)sulfonylpiperidine-4-carboxamide
CID 39752679

Frequently Asked Questions

What is the IUPAC name of 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide (CID 75373447) is 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide is CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccc4nccn34)CC2)c1.
What is the InChIKey of 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide?
The InChIKey is YEJCQJSXJODBHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O4S/c1-15(26)17-4-2-5-18(14-17)30(28,29)24-11-8-16(9-12-24)21(27)23-20-7-3-6-19-22-10-13-25(19)20/h2-7,10,13-14,16H,8-9,11-12H2,1H3,(H,23,27).
What are the key properties of 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide?
1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide has a molecular weight of 426.50 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-acetylphenyl)sulfonyl-N-imidazo[1,2-a]pyridin-5-ylpiperidine-4-carboxamide is sourced from PubChem (CID 75373447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).