3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide

C15H11ClN4O — CID 66483325

IUPAC3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc(-n2cccn2)cc1)c1ccncc1Cl
InChIInChI=1S/C15H11ClN4O/c16-14-10-17-8-6-13(14)15(21)19-11-2-4-12(5-3-11)20-9-1-7-18-20/h1-10H,(H,19,21)
InChIKeyHAHBZPMBAYECTE-UHFFFAOYSA-N
MW298.73 g/mol
LogP3.17
Rot. Bonds3

About 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide

3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide (PubChem CID 66483325) has the molecular formula C15H11ClN4O and a molecular weight of 298.73 g/mol. Its IUPAC name is 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide
PubChem CID66483325
Molecular FormulaC15H11ClN4O
Molecular Weight298.73 g/mol
Exact Mass298.06
IUPAC Name3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc(-n2cccn2)cc1)c1ccncc1Cl
InChIInChI=1S/C15H11ClN4O/c16-14-10-17-8-6-13(14)15(21)19-11-2-4-12(5-3-11)20-9-1-7-18-20/h1-10H,(H,19,21)
InChIKeyHAHBZPMBAYECTE-UHFFFAOYSA-N
XLogP3.17
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.73
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-(4-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 66483334
5-chloro-N-(4-pyrazol-1-ylphenyl)pyrazine-2-carboxamide
CID 107247017
4-pyrazol-1-yl-N-pyridin-4-ylbenzamide
CID 27700232
N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
CID 35275358
5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
CID 62955085
3-chloro-N-[4-(1,3-dioxolan-2-yl)phenyl]pyridine-4-carboxamide
CID 106913068
2-[4-[(3-chloropyridine-4-carbonyl)amino]phenyl]-2-methylpropanoic acid
CID 138041122
3-chloro-N-[4-(trifluoromethylsulfanyl)phenyl]pyridine-4-carboxamide
CID 66484493
3-chloro-N-(3-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 66462445
N-(3,5-dichlorophenyl)-4-pyrazol-1-ylbenzamide
CID 46813346
3-chloro-N-quinolin-6-ylpyridine-4-carboxamide
CID 66484536
4-bromo-N-(4-pyrazol-1-ylphenyl)-1H-pyrazole-5-carboxamide
CID 35535373

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide?
The IUPAC name of 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide (CID 66483325) is 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide is O=C(Nc1ccc(-n2cccn2)cc1)c1ccncc1Cl.
What is the InChIKey of 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide?
The InChIKey is HAHBZPMBAYECTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN4O/c16-14-10-17-8-6-13(14)15(21)19-11-2-4-12(5-3-11)20-9-1-7-18-20/h1-10H,(H,19,21).
What are the key properties of 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide?
3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide has a molecular weight of 298.73 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 66483325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).