5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide

C15H11BrN4O — CID 62955085

IUPAC5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(-n2cccn2)cc1)c1ccc(Br)cn1
InChIInChI=1S/C15H11BrN4O/c16-11-2-7-14(17-10-11)15(21)19-12-3-5-13(6-4-12)20-9-1-8-18-20/h1-10H,(H,19,21)
InChIKeyQZJOWWWUESKFFL-UHFFFAOYSA-N
MW343.18 g/mol
LogP3.28
Rot. Bonds3

About 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide

5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide (PubChem CID 62955085) has the molecular formula C15H11BrN4O and a molecular weight of 343.18 g/mol. Its IUPAC name is 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
PubChem CID62955085
Molecular FormulaC15H11BrN4O
Molecular Weight343.18 g/mol
Exact Mass342.01
IUPAC Name5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(-n2cccn2)cc1)c1ccc(Br)cn1
InChIInChI=1S/C15H11BrN4O/c16-11-2-7-14(17-10-11)15(21)19-12-3-5-13(6-4-12)20-9-1-8-18-20/h1-10H,(H,19,21)
InChIKeyQZJOWWWUESKFFL-UHFFFAOYSA-N
XLogP3.28
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.18
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-[4-(triazol-2-yl)phenyl]pyridine-2-carboxamide
CID 62954396
5-chloro-N-(4-pyrazol-1-ylphenyl)pyrazine-2-carboxamide
CID 107247017
N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
CID 35275358
4-bromo-N-(4-pyrazol-1-ylphenyl)-1H-pyrazole-5-carboxamide
CID 35535373
5-bromo-N-(2-pyrazol-1-yl-3-pyridinyl)pyridine-2-carboxamide
CID 62952714
5-bromo-N-[4-(1,2,4-triazol-4-yl)phenyl]pyridine-2-carboxamide
CID 99797834
3-bromo-N-(4-pyrazol-1-ylphenyl)benzamide
CID 35761421
5-bromo-N-(1-phenylpyrazol-4-yl)pyridine-2-carboxamide
CID 99816223
3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide
CID 66483325
4-bromo-N-[2-oxo-2-(4-pyrazol-1-ylanilino)ethyl]benzamide
CID 55980228
5-bromo-N-[4-(methylcarbamoylamino)phenyl]pyridine-2-carboxamide
CID 62954926
1-(4-bromophenyl)pyrazole
CID 10443564

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide (CID 62955085) is 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide is O=C(Nc1ccc(-n2cccn2)cc1)c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide?
The InChIKey is QZJOWWWUESKFFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN4O/c16-11-2-7-14(17-10-11)15(21)19-12-3-5-13(6-4-12)20-9-1-8-18-20/h1-10H,(H,19,21).
What are the key properties of 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide?
5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide has a molecular weight of 343.18 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62955085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).