N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide

C22H18N4O3 — CID 44827298

IUPACN-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cn(C)cc3c(=O)n(-c4ccccc4)nc2-3)c1
InChIInChI=1S/C22H18N4O3/c1-14(27)15-7-6-8-16(11-15)23-21(28)18-12-25(2)13-19-20(18)24-26(22(19)29)17-9-4-3-5-10-17/h3-13H,1-2H3,(H,23,28)
InChIKeyIXBZXXUKBKKGKI-UHFFFAOYSA-N
MW386.41 g/mol
LogP3.13
Rot. Bonds4

About N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide

N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide (PubChem CID 44827298) has the molecular formula C22H18N4O3 and a molecular weight of 386.41 g/mol. Its IUPAC name is N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
PubChem CID44827298
Molecular FormulaC22H18N4O3
Molecular Weight386.41 g/mol
Exact Mass386.14
IUPAC NameN-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cn(C)cc3c(=O)n(-c4ccccc4)nc2-3)c1
InChIInChI=1S/C22H18N4O3/c1-14(27)15-7-6-8-16(11-15)23-21(28)18-12-25(2)13-19-20(18)24-26(22(19)29)17-9-4-3-5-10-17/h3-13H,1-2H3,(H,23,28)
InChIKeyIXBZXXUKBKKGKI-UHFFFAOYSA-N
XLogP3.13
TPSA85.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.41
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methoxyphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
CID 16801788
5-benzyl-N-(3-methoxyphenyl)-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
CID 18570534
N-(4-acetylphenyl)-3-oxo-5-[[(2S)-oxolan-2-yl]methyl]-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
CID 92522852
N-(4-ethylphenyl)-3-oxo-2-phenyl-5-propylpyrazolo[4,3-c]pyridine-7-carboxamide
CID 18570396
N-(3-acetylphenyl)-3-(2,4-dimethoxyphenyl)-1-phenylpyrazole-4-carboxamide
CID 29206588
3-N,4-N-bis(3-acetylphenyl)-1-methylpyrazole-3,4-dicarboxamide
CID 29097609
3-(2,4-dimethylphenyl)-N-[3-(methylcarbamoyl)phenyl]-1-phenylpyrazole-4-carboxamide
CID 112767352
N-(3-acetylphenyl)-4-oxo-3-phenylquinazoline-7-carboxamide
CID 39333619
3-[[3-(5-methylthiophen-2-yl)-1-phenylpyrazole-4-carbonyl]amino]benzoic acid
CID 142738645
5-ethyl-N-(2-fluorophenyl)-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
CID 18570321
N-(3-acetylphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 61059268
5-benzyl-N-(6-methyl-2-pyridinyl)-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
CID 18570540

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide (CID 44827298) is N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide is CC(=O)c1cccc(NC(=O)c2cn(C)cc3c(=O)n(-c4ccccc4)nc2-3)c1.
What is the InChIKey of N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide?
The InChIKey is IXBZXXUKBKKGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O3/c1-14(27)15-7-6-8-16(11-15)23-21(28)18-12-25(2)13-19-20(18)24-26(22(19)29)17-9-4-3-5-10-17/h3-13H,1-2H3,(H,23,28).
What are the key properties of N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide?
N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide has a molecular weight of 386.41 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-5-methyl-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 44827298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).