5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide

C9H7BrN4O — CID 55209020

IUPAC5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide
SMILESO=C(Nc1ccn[nH]1)c1ccc(Br)cn1
InChIInChI=1S/C9H7BrN4O/c10-6-1-2-7(11-5-6)9(15)13-8-3-4-12-14-8/h1-5H,(H2,12,13,14,15)
InChIKeyOIQWXJAVIMRZPM-UHFFFAOYSA-N
MW267.09 g/mol
LogP1.82
Rot. Bonds2

About 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide

5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide (PubChem CID 55209020) has the molecular formula C9H7BrN4O and a molecular weight of 267.09 g/mol. Its IUPAC name is 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide
PubChem CID55209020
Molecular FormulaC9H7BrN4O
Molecular Weight267.09 g/mol
Exact Mass265.98
IUPAC Name5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide
SMILESO=C(Nc1ccn[nH]1)c1ccc(Br)cn1
InChIInChI=1S/C9H7BrN4O/c10-6-1-2-7(11-5-6)9(15)13-8-3-4-12-14-8/h1-5H,(H2,12,13,14,15)
InChIKeyOIQWXJAVIMRZPM-UHFFFAOYSA-N
XLogP1.82
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.09
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide (CID 55209020) is 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide is O=C(Nc1ccn[nH]1)c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide?
The InChIKey is OIQWXJAVIMRZPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrN4O/c10-6-1-2-7(11-5-6)9(15)13-8-3-4-12-14-8/h1-5H,(H2,12,13,14,15).
What are the key properties of 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide?
5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide has a molecular weight of 267.09 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 55209020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).