N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide

C19H20N4O — CID 99713995

IUPACN-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide
SMILESCc1cccnc1NC(=O)c1cc(C(C)C)n(-c2ccccc2)n1
InChIInChI=1S/C19H20N4O/c1-13(2)17-12-16(22-23(17)15-9-5-4-6-10-15)19(24)21-18-14(3)8-7-11-20-18/h4-13H,1-3H3,(H,20,21,24)
InChIKeyLKBTYLIHPLIVCU-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.95
Rot. Bonds4

About N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide

N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide (PubChem CID 99713995) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide
PubChem CID99713995
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC NameN-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide
SMILESCc1cccnc1NC(=O)c1cc(C(C)C)n(-c2ccccc2)n1
InChIInChI=1S/C19H20N4O/c1-13(2)17-12-16(22-23(17)15-9-5-4-6-10-15)19(24)21-18-14(3)8-7-11-20-18/h4-13H,1-3H3,(H,20,21,24)
InChIKeyLKBTYLIHPLIVCU-UHFFFAOYSA-N
XLogP3.95
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methyl-2-pyridinyl)-6-oxo-1-phenylpyridazine-3-carboxamide
CID 31903731
2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 4216500
1-(4-methylphenyl)-5-propan-2-ylpyrazole-3-carboxylic acid
CID 22831933
2-[(3-methyl-2-pyridinyl)carbamoyl]benzoic acid
CID 738391
4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(3-methyl-2-pyridinyl)benzamide
CID 35032045
N-[4-methyl-3-(1,3-oxazol-2-yl)phenyl]-5-propan-2-yl-1-pyridin-2-ylpyrazole-3-carboxamide
CID 99696326
5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide
CID 47293177
1-(5-propan-2-yl-1-pyridin-2-ylpyrazol-3-yl)ethanone
CID 170580254
1-methyl-5-propan-2-yl-N-pyridin-2-ylpyrazole-3-carboxamide
CID 110674207
6-methyl-N-(3-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 46642959
(2R)-N-(3-methyl-2-pyridinyl)-2-phenylsulfanylpropanamide
CID 39951954
N-(3-methyl-2-pyridinyl)-2-[2-[(3-methyl-2-pyridinyl)carbamoyl]phenyl]benzamide
CID 1108359

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide?
The IUPAC name of N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide (CID 99713995) is N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide.
What is the SMILES notation for N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide?
The canonical SMILES for N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide is Cc1cccnc1NC(=O)c1cc(C(C)C)n(-c2ccccc2)n1.
What is the InChIKey of N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide?
The InChIKey is LKBTYLIHPLIVCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13(2)17-12-16(22-23(17)15-9-5-4-6-10-15)19(24)21-18-14(3)8-7-11-20-18/h4-13H,1-3H3,(H,20,21,24).
What are the key properties of N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide?
N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide has a molecular weight of 320.40 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-pyridinyl)-1-phenyl-5-propan-2-ylpyrazole-3-carboxamide is sourced from PubChem (CID 99713995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).