1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide

C14H16N4O2 — CID 124627502

IUPAC1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide
SMILESC[C@H]1C[C@H]1c1cc(NC(=O)c2ccn(C)c(=O)c2)n[nH]1
InChIInChI=1S/C14H16N4O2/c1-8-5-10(8)11-7-12(17-16-11)15-14(20)9-3-4-18(2)13(19)6-9/h3-4,6-8,10H,5H2,1-2H3,(H2,15,16,17,20)/t8-,10+/m0/s1
InChIKeyJMTITHDIBDMITK-WCBMZHEXSA-N
MW272.31 g/mol
LogP1.48
Rot. Bonds3

About 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide

1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide (PubChem CID 124627502) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide
PubChem CID124627502
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide
SMILESC[C@H]1C[C@H]1c1cc(NC(=O)c2ccn(C)c(=O)c2)n[nH]1
InChIInChI=1S/C14H16N4O2/c1-8-5-10(8)11-7-12(17-16-11)15-14(20)9-3-4-18(2)13(19)6-9/h3-4,6-8,10H,5H2,1-2H3,(H2,15,16,17,20)/t8-,10+/m0/s1
InChIKeyJMTITHDIBDMITK-WCBMZHEXSA-N
XLogP1.48
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide with MolForge

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Related Compounds

1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide
CID 124607479
N-[5-(2-methylcyclopropyl)-1H-pyrazol-3-yl]cyclopropanecarboxamide
CID 167975175
1-methyl-2-oxo-N-pyrazin-2-ylpyridine-4-carboxamide
CID 113221321
N-(4,5-dimethyl-1H-pyrazol-3-yl)-1-methyl-2-oxopyridine-4-carboxamide
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N-(1H-imidazol-2-yl)-1-methyl-2-oxopyridine-4-carboxamide
CID 60966951
1-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-3-[5-[(1S,2R)-2-methylcyclopropyl]-1H-pyrazol-3-yl]urea
CID 99835836
5-methyl-N-[5-(2-methylcyclopropyl)-1H-pyrazol-3-yl]-1-(2-propan-2-ylphenyl)-1,2,4-triazole-3-carboxamide
CID 155947831
1-methyl-2-oxo-N-(piperidin-4-ylmethyl)pyridine-4-carboxamide
CID 103793623
N-cyclooctyl-1-methyl-2-oxopyridine-4-carboxamide
CID 103610769
1-methyl-N-(3-methylcyclopentyl)-2-oxopyridine-4-carboxamide
CID 114549550
1-methyl-N-(3-methyl-2-pyridinyl)-2-oxopyridine-4-carboxamide
CID 103610894
N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103610749

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide?
The IUPAC name of 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide (CID 124627502) is 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide?
The canonical SMILES for 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide is C[C@H]1C[C@H]1c1cc(NC(=O)c2ccn(C)c(=O)c2)n[nH]1.
What is the InChIKey of 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide?
The InChIKey is JMTITHDIBDMITK-WCBMZHEXSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-8-5-10(8)11-7-12(17-16-11)15-14(20)9-3-4-18(2)13(19)6-9/h3-4,6-8,10H,5H2,1-2H3,(H2,15,16,17,20)/t8-,10+/m0/s1.
What are the key properties of 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide?
1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 124627502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).