5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide

C15H12BrN5O — CID 2999617

IUPAC5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cncc(Br)c2)n(-c2ccccn2)n1
InChIInChI=1S/C15H12BrN5O/c1-10-6-14(21(20-10)13-4-2-3-5-18-13)19-15(22)11-7-12(16)9-17-8-11/h2-9H,1H3,(H,19,22)
InChIKeyLQRAIFKLVHANJC-UHFFFAOYSA-N
MW358.20 g/mol
LogP2.99
Rot. Bonds3

About 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide

5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide (PubChem CID 2999617) has the molecular formula C15H12BrN5O and a molecular weight of 358.20 g/mol. Its IUPAC name is 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide
PubChem CID2999617
Molecular FormulaC15H12BrN5O
Molecular Weight358.20 g/mol
Exact Mass357.02
IUPAC Name5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cncc(Br)c2)n(-c2ccccn2)n1
InChIInChI=1S/C15H12BrN5O/c1-10-6-14(21(20-10)13-4-2-3-5-18-13)19-15(22)11-7-12(16)9-17-8-11/h2-9H,1H3,(H,19,22)
InChIKeyLQRAIFKLVHANJC-UHFFFAOYSA-N
XLogP2.99
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.20
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 3966984
2-(4-bromo-2-methylphenyl)sulfanyl-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)acetamide
CID 112807213
5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 29367937
(2R)-2-methoxy-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)-2-phenylacetamide
CID 124616132
N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)-2-phenylquinoline-4-carboxamide
CID 112772630
N-[2-(3,5-dichloro-2-pyridinyl)-5-methylpyrazol-3-yl]pyridine-3-carboxamide
CID 108756056
1-cyclopropyl-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide
CID 138996070
N-(3-tert-butyl-1-pyridin-2-ylpyrazol-5-yl)-4-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide
CID 56531464
5-bromo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide
CID 86992070
N'-benzoyl-5-bromopyridine-3-carbohydrazide
CID 40613239
2-[4-[4-(hydroxymethyl)phenyl]pyrazol-1-yl]-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)acetamide
CID 46986305

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide (CID 2999617) is 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide is Cc1cc(NC(=O)c2cncc(Br)c2)n(-c2ccccn2)n1.
What is the InChIKey of 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide?
The InChIKey is LQRAIFKLVHANJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN5O/c1-10-6-14(21(20-10)13-4-2-3-5-18-13)19-15(22)11-7-12(16)9-17-8-11/h2-9H,1H3,(H,19,22).
What are the key properties of 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide?
5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide has a molecular weight of 358.20 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 2999617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).