2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide

C14H12BrClFN3O — CID 107616628

IUPAC2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide
SMILESCCc1cc(C(=O)Nc2c(Cl)cc(F)cc2Br)cc(N)n1
InChIInChI=1S/C14H12BrClFN3O/c1-2-9-3-7(4-12(18)19-9)14(21)20-13-10(15)5-8(17)6-11(13)16/h3-6H,2H2,1H3,(H2,18,19)(H,20,21)
InChIKeyXVTSRZTXRRZGDR-UHFFFAOYSA-N
MW372.63 g/mol
LogP4.03
Rot. Bonds3

About 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide

2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide (PubChem CID 107616628) has the molecular formula C14H12BrClFN3O and a molecular weight of 372.63 g/mol. Its IUPAC name is 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide
PubChem CID107616628
Molecular FormulaC14H12BrClFN3O
Molecular Weight372.63 g/mol
Exact Mass370.98
IUPAC Name2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide
SMILESCCc1cc(C(=O)Nc2c(Cl)cc(F)cc2Br)cc(N)n1
InChIInChI=1S/C14H12BrClFN3O/c1-2-9-3-7(4-12(18)19-9)14(21)20-13-10(15)5-8(17)6-11(13)16/h3-6H,2H2,1H3,(H2,18,19)(H,20,21)
InChIKeyXVTSRZTXRRZGDR-UHFFFAOYSA-N
XLogP4.03
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.63
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide
CID 107631716
3-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-5-fluoro-4-methylbenzamide
CID 107608760
2-(2-bromo-6-chloro-4-fluoroanilino)-6-ethylpyridine-4-carboxylic acid
CID 107613288
N-(2-bromo-6-chloro-4-fluorophenyl)-4-(bromomethyl)benzamide
CID 107610811
N-(2-bromo-6-chloro-4-fluorophenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 103874009
N-(2-bromo-6-chloro-4-fluorophenyl)-6-chloropyridine-3-carboxamide
CID 103867801
2-amino-N-(4-chloro-3-methoxyphenyl)-6-ethylpyridine-4-carboxamide
CID 107623056
2-amino-N-(2-bromo-4-cyanophenyl)-6-ethylpyridine-4-carboxamide
CID 107793724
2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide
CID 62155953
N-(2-bromo-6-chloro-4-fluorophenyl)-3,6-dichloropyridine-2-carboxamide
CID 103867824
5-amino-2-bromo-N-(2-bromo-6-chloro-4-fluorophenyl)benzamide
CID 107608774
N-(2-bromo-6-chloro-4-fluorophenyl)-4-propylthiadiazole-5-carboxamide
CID 107612541

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide (CID 107616628) is 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide is CCc1cc(C(=O)Nc2c(Cl)cc(F)cc2Br)cc(N)n1.
What is the InChIKey of 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The InChIKey is XVTSRZTXRRZGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrClFN3O/c1-2-9-3-7(4-12(18)19-9)14(21)20-13-10(15)5-8(17)6-11(13)16/h3-6H,2H2,1H3,(H2,18,19)(H,20,21).
What are the key properties of 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide?
2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide has a molecular weight of 372.63 g/mol, XLogP of 4.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide is sourced from PubChem (CID 107616628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).