N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide

C19H20N4O2 — CID 99696822

IUPACN-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1ccc(C)c(-n2ncc(NC(=O)c3cc(C)[nH]c(=O)c3)c2C)c1
InChIInChI=1S/C19H20N4O2/c1-11-5-6-12(2)17(7-11)23-14(4)16(10-20-23)22-19(25)15-8-13(3)21-18(24)9-15/h5-10H,1-4H3,(H,21,24)(H,22,25)
InChIKeyCFOTZKDTBDCOIX-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.05
Rot. Bonds3

About N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide

N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 99696822) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide
PubChem CID99696822
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1ccc(C)c(-n2ncc(NC(=O)c3cc(C)[nH]c(=O)c3)c2C)c1
InChIInChI=1S/C19H20N4O2/c1-11-5-6-12(2)17(7-11)23-14(4)16(10-20-23)22-19(25)15-8-13(3)21-18(24)9-15/h5-10H,1-4H3,(H,21,24)(H,22,25)
InChIKeyCFOTZKDTBDCOIX-UHFFFAOYSA-N
XLogP3.05
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-4,5-difluorobenzamide
CID 99696284
2-[[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]amino]propanamide
CID 86802649
5-(acetamidomethyl)-N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]thiophene-2-carboxamide
CID 99696230
3-[[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]carbamoylamino]-2-hydroxy-2-methylpropanoic acid
CID 122087413
1-(2,5-dimethylphenyl)-5-methyl-N-methylsulfonylpyrazole-4-carboxamide
CID 146154766
1-[[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]carbamoyl]pyrrolidine-3-carboxylic acid
CID 122087409
N-[5-[(dimethylamino)methyl]-2-methylphenyl]-1-(2,5-dimethylphenyl)-5-methylpyrazole-4-carboxamide
CID 99612955
2-hydroxy-N-(2-hydroxy-4-methylphenyl)-6-oxo-1H-pyridine-4-carboxamide
CID 61269753
1-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-3-[[4-(4-fluorophenoxy)-3-methylphenyl]methyl]urea
CID 166319052
(3R)-3-[[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]amino]-1-methylpyrrolidin-2-one
CID 99616166
N-(2,5-dimethylphenyl)-4-iodo-1-methylpyrazole-5-carboxamide
CID 19476120
5-bromo-N-[1-(2-fluorophenyl)-5-methylpyrazol-4-yl]thiophene-3-carboxamide
CID 99626490

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide (CID 99696822) is N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide is Cc1ccc(C)c(-n2ncc(NC(=O)c3cc(C)[nH]c(=O)c3)c2C)c1.
What is the InChIKey of N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is CFOTZKDTBDCOIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-11-5-6-12(2)17(7-11)23-14(4)16(10-20-23)22-19(25)15-8-13(3)21-18(24)9-15/h5-10H,1-4H3,(H,21,24)(H,22,25).
What are the key properties of N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 99696822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).