5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide

C10H10BrClN2O — CID 130550487

IUPAC5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide
SMILESCN(C(=O)c1cnc(Cl)c(Br)c1)C1CC1
InChIInChI=1S/C10H10BrClN2O/c1-14(7-2-3-7)10(15)6-4-8(11)9(12)13-5-6/h4-5,7H,2-3H2,1H3
InChIKeyJKRJBSBZPNJCKC-UHFFFAOYSA-N
MW289.56 g/mol
LogP2.73
Rot. Bonds2

About 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide

5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide (PubChem CID 130550487) has the molecular formula C10H10BrClN2O and a molecular weight of 289.56 g/mol. Its IUPAC name is 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide
PubChem CID130550487
Molecular FormulaC10H10BrClN2O
Molecular Weight289.56 g/mol
Exact Mass287.97
IUPAC Name5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide
SMILESCN(C(=O)c1cnc(Cl)c(Br)c1)C1CC1
InChIInChI=1S/C10H10BrClN2O/c1-14(7-2-3-7)10(15)6-4-8(11)9(12)13-5-6/h4-5,7H,2-3H2,1H3
InChIKeyJKRJBSBZPNJCKC-UHFFFAOYSA-N
XLogP2.73
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.56
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-bromo-6-chloro-N-methyl-N-propan-2-ylpyridine-3-carboxamide
CID 130550438
5,6-dichloro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-3-carboxamide
CID 61051847
2-bromo-N-cyclopropyl-N-methylpyridine-4-carboxamide
CID 103752625
N-cyclopropyl-5-hydroxy-N-methylpyridine-3-carboxamide
CID 63865500
5-bromo-6-chloropyridine-3-carboxylic acid;hydrazine
CID 174723335
5-chloro-N-methyl-6-(methylamino)-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
CID 62166006
4-bromo-3-chloro-N-cyclopropyl-N-methyl-5-sulfamoylbenzamide
CID 81290579
3-chloro-N-cyclopropyl-N-methylbenzamide
CID 110726716
5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid
CID 60725247
5-bromo-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
CID 60636354
6-chloro-N-methyl-N-(4-phenylcyclohexyl)pyridine-3-carboxamide
CID 134022024
5,6-dichloro-N-methyl-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide
CID 82734080

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide?
The IUPAC name of 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide (CID 130550487) is 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide?
The canonical SMILES for 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide is CN(C(=O)c1cnc(Cl)c(Br)c1)C1CC1.
What is the InChIKey of 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide?
The InChIKey is JKRJBSBZPNJCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrClN2O/c1-14(7-2-3-7)10(15)6-4-8(11)9(12)13-5-6/h4-5,7H,2-3H2,1H3.
What are the key properties of 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide?
5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide has a molecular weight of 289.56 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 130550487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).