5-bromo-3-chloro-N-ethylpyridine-2-carboxamide

C8H8BrClN2O — CID 155923575

IUPAC5-bromo-3-chloro-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1ncc(Br)cc1Cl
InChIInChI=1S/C8H8BrClN2O/c1-2-11-8(13)7-6(10)3-5(9)4-12-7/h3-4H,2H2,1H3,(H,11,13)
InChIKeySGESSMVSHDBUPM-UHFFFAOYSA-N
MW263.52 g/mol
LogP2.25
Rot. Bonds2

About 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide

5-bromo-3-chloro-N-ethylpyridine-2-carboxamide (PubChem CID 155923575) has the molecular formula C8H8BrClN2O and a molecular weight of 263.52 g/mol. Its IUPAC name is 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-3-chloro-N-ethylpyridine-2-carboxamide
PubChem CID155923575
Molecular FormulaC8H8BrClN2O
Molecular Weight263.52 g/mol
Exact Mass261.95
IUPAC Name5-bromo-3-chloro-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1ncc(Br)cc1Cl
InChIInChI=1S/C8H8BrClN2O/c1-2-11-8(13)7-6(10)3-5(9)4-12-7/h3-4H,2H2,1H3,(H,11,13)
InChIKeySGESSMVSHDBUPM-UHFFFAOYSA-N
XLogP2.25
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.52
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-3-chloro-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
CID 70896660
5-bromo-3-chloro-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 155923576
1-(5-bromo-3-chloro-2-pyridinyl)propan-1-one
CID 174823193
5-bromo-3-chloro-N-propan-2-ylpyridine-2-carboxamide
CID 155923574
1-(5-bromo-3-chloro-2-pyridinyl)-N-ethylpiperazine-2-carboxamide
CID 103582821
5-bromo-3-fluoro-N-propylpyridine-2-carboxamide
CID 146027056
5-bromo-N-ethyl-1-methylpyrrolo[2,3-b]pyridine-3-carboxamide
CID 145183128
3,4-dichloro-N-ethylpyridine-2-carboxamide
CID 123182063
methyl 2-[(5-bromo-3-chloro-2-pyridinyl)methylamino]-2-oxoacetate
CID 170566955
2-chloro-N-ethyl-1,3-thiazole-5-carboxamide
CID 170344916
2-(5-bromo-3-chloro-2-pyridinyl)butanoic acid
CID 103584278
2-[6-[(5-bromo-3-chloropyridine-2-carbonyl)amino]-3-fluoro-2-pyridinyl]ethyl N'-methylcarbamimidate
CID 139564340

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide?
The IUPAC name of 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide (CID 155923575) is 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide is CCNC(=O)c1ncc(Br)cc1Cl.
What is the InChIKey of 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide?
The InChIKey is SGESSMVSHDBUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrClN2O/c1-2-11-8(13)7-6(10)3-5(9)4-12-7/h3-4H,2H2,1H3,(H,11,13).
What are the key properties of 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide?
5-bromo-3-chloro-N-ethylpyridine-2-carboxamide has a molecular weight of 263.52 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 155923575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).