5-bromo-N-methylpyridine-2-carboxamide

C7H7BrN2O — CID 22831620

IUPAC5-bromo-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1ccc(Br)cn1
InChIInChI=1S/C7H7BrN2O/c1-9-7(11)6-3-2-5(8)4-10-6/h2-4H,1H3,(H,9,11)
InChIKeyOHYCXPXWHPWYFX-UHFFFAOYSA-N
MW215.05 g/mol
LogP1.20
Rot. Bonds1

About 5-bromo-N-methylpyridine-2-carboxamide

5-bromo-N-methylpyridine-2-carboxamide (PubChem CID 22831620) has the molecular formula C7H7BrN2O and a molecular weight of 215.05 g/mol. Its IUPAC name is 5-bromo-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-methylpyridine-2-carboxamide
PubChem CID22831620
Molecular FormulaC7H7BrN2O
Molecular Weight215.05 g/mol
Exact Mass213.97
IUPAC Name5-bromo-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1ccc(Br)cn1
InChIInChI=1S/C7H7BrN2O/c1-9-7(11)6-3-2-5(8)4-10-6/h2-4H,1H3,(H,9,11)
InChIKeyOHYCXPXWHPWYFX-UHFFFAOYSA-N
XLogP1.20
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.05
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-N-methylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-methylpyridine-2-carboxamide?
The IUPAC name of 5-bromo-N-methylpyridine-2-carboxamide (CID 22831620) is 5-bromo-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-N-methylpyridine-2-carboxamide?
The canonical SMILES for 5-bromo-N-methylpyridine-2-carboxamide is CNC(=O)c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-methylpyridine-2-carboxamide?
The InChIKey is OHYCXPXWHPWYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrN2O/c1-9-7(11)6-3-2-5(8)4-10-6/h2-4H,1H3,(H,9,11).
What are the key properties of 5-bromo-N-methylpyridine-2-carboxamide?
5-bromo-N-methylpyridine-2-carboxamide has a molecular weight of 215.05 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 22831620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).