5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide

C19H16N6O2 — CID 136834812

IUPAC5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide
SMILESCc1nc(NC(=O)c2cnn(-c3ccc4ccccc4n3)c2C)cc(=O)[nH]1
InChIInChI=1S/C19H16N6O2/c1-11-14(19(27)24-16-9-18(26)22-12(2)21-16)10-20-25(11)17-8-7-13-5-3-4-6-15(13)23-17/h3-10H,1-2H3,(H2,21,22,24,26,27)
InChIKeyLKIMNRBLYJVYFK-UHFFFAOYSA-N
MW360.38 g/mol
LogP2.37
Rot. Bonds3

About 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide

5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide (PubChem CID 136834812) has the molecular formula C19H16N6O2 and a molecular weight of 360.38 g/mol. Its IUPAC name is 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide
PubChem CID136834812
Molecular FormulaC19H16N6O2
Molecular Weight360.38 g/mol
Exact Mass360.13
IUPAC Name5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide
SMILESCc1nc(NC(=O)c2cnn(-c3ccc4ccccc4n3)c2C)cc(=O)[nH]1
InChIInChI=1S/C19H16N6O2/c1-11-14(19(27)24-16-9-18(26)22-12(2)21-16)10-20-25(11)17-8-7-13-5-3-4-6-15(13)23-17/h3-10H,1-2H3,(H2,21,22,24,26,27)
InChIKeyLKIMNRBLYJVYFK-UHFFFAOYSA-N
XLogP2.37
TPSA105.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.38
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide with MolForge

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Related Compounds

5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 136834839
5-methyl-N-(2-oxo-1H-pyrimidin-6-yl)-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108801801
N-(3-chlorophenyl)-5-methyl-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108801833
5-methyl-N-(2-methyl-6-propan-2-ylphenyl)-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108788845
5-methyl-1-phenyl-N-quinolin-2-ylpyrazole-4-carboxamide
CID 137375534
N-(4-acetylphenyl)-5-methyl-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108801834
N-(5-chloro-2-methylphenyl)-5-methyl-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108788906
N-(3-chloro-4-methylphenyl)-5-methyl-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108788844
N-(4-carbamoylphenyl)-5-methyl-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108789021
dimethyl 2-[(5-methyl-1-quinolin-2-ylpyrazole-4-carbonyl)amino]benzene-1,4-dicarboxylate
CID 108788953
N-(2-aminoethyl)-5-methyl-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108788938
N-(2-methoxy-5-methylphenyl)-5-methyl-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108801781

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide (CID 136834812) is 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide is Cc1nc(NC(=O)c2cnn(-c3ccc4ccccc4n3)c2C)cc(=O)[nH]1.
What is the InChIKey of 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide?
The InChIKey is LKIMNRBLYJVYFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O2/c1-11-14(19(27)24-16-9-18(26)22-12(2)21-16)10-20-25(11)17-8-7-13-5-3-4-6-15(13)23-17/h3-10H,1-2H3,(H2,21,22,24,26,27).
What are the key properties of 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide?
5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide has a molecular weight of 360.38 g/mol, XLogP of 2.37, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-1-quinolin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 136834812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).