1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide

C15H20N4O2 — CID 124607479

IUPAC1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide
SMILESCCC[C@H](C)c1cc(NC(=O)c2ccn(C)c(=O)c2)n[nH]1
InChIInChI=1S/C15H20N4O2/c1-4-5-10(2)12-9-13(18-17-12)16-15(21)11-6-7-19(3)14(20)8-11/h6-10H,4-5H2,1-3H3,(H2,16,17,18,21)/t10-/m0/s1
InChIKeyAAYSZEBPUZBXHU-JTQLQIEISA-N
MW288.35 g/mol
LogP2.26
Rot. Bonds5

About 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide

1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide (PubChem CID 124607479) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide
PubChem CID124607479
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide
SMILESCCC[C@H](C)c1cc(NC(=O)c2ccn(C)c(=O)c2)n[nH]1
InChIInChI=1S/C15H20N4O2/c1-4-5-10(2)12-9-13(18-17-12)16-15(21)11-6-7-19(3)14(20)8-11/h6-10H,4-5H2,1-3H3,(H2,16,17,18,21)/t10-/m0/s1
InChIKeyAAYSZEBPUZBXHU-JTQLQIEISA-N
XLogP2.26
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide with MolForge

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Related Compounds

N-(5-pentan-2-yl-1H-pyrazol-3-yl)pyridine-3-carboxamide
CID 71989878
4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide
CID 96518937
1-methyl-N-[5-[(1R,2S)-2-methylcyclopropyl]-1H-pyrazol-3-yl]-2-oxopyridine-4-carboxamide
CID 124627502
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
CID 115610262
N-[5-[(2R)-pentan-2-yl]-1H-pyrazol-3-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 96518938
1-[(1-methylpyrazol-4-yl)methyl]-3-(5-pentan-2-yl-1H-pyrazol-3-yl)urea
CID 71873802
1-methyl-N-(3-methylbutyl)-2-oxopyridine-4-carboxamide
CID 35556772
N-(1H-imidazol-2-yl)-1-methyl-2-oxopyridine-4-carboxamide
CID 60966951
4-bromo-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 5330993
N-(4-ethoxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103610716
N-[2-(2-chloroethyl)pentyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 106117560

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide?
The IUPAC name of 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide (CID 124607479) is 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide.
What is the SMILES notation for 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide?
The canonical SMILES for 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide is CCC[C@H](C)c1cc(NC(=O)c2ccn(C)c(=O)c2)n[nH]1.
What is the InChIKey of 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide?
The InChIKey is AAYSZEBPUZBXHU-JTQLQIEISA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-5-10(2)12-9-13(18-17-12)16-15(21)11-6-7-19(3)14(20)8-11/h6-10H,4-5H2,1-3H3,(H2,16,17,18,21)/t10-/m0/s1.
What are the key properties of 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide?
1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide is sourced from PubChem (CID 124607479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).