2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide

C14H13BrFN3O — CID 107631716

IUPAC2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide
SMILESCCc1cc(C(=O)Nc2cc(F)ccc2Br)cc(N)n1
InChIInChI=1S/C14H13BrFN3O/c1-2-10-5-8(6-13(17)18-10)14(20)19-12-7-9(16)3-4-11(12)15/h3-7H,2H2,1H3,(H2,17,18)(H,19,20)
InChIKeyOWMCFUYWGCTJSA-UHFFFAOYSA-N
MW338.18 g/mol
LogP3.38
Rot. Bonds3

About 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide

2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide (PubChem CID 107631716) has the molecular formula C14H13BrFN3O and a molecular weight of 338.18 g/mol. Its IUPAC name is 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide
PubChem CID107631716
Molecular FormulaC14H13BrFN3O
Molecular Weight338.18 g/mol
Exact Mass337.02
IUPAC Name2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide
SMILESCCc1cc(C(=O)Nc2cc(F)ccc2Br)cc(N)n1
InChIInChI=1S/C14H13BrFN3O/c1-2-10-5-8(6-13(17)18-10)14(20)19-12-7-9(16)3-4-11(12)15/h3-7H,2H2,1H3,(H2,17,18)(H,19,20)
InChIKeyOWMCFUYWGCTJSA-UHFFFAOYSA-N
XLogP3.38
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.18
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-bromo-5-fluorophenyl)-6-propan-2-ylpyridine-4-carboxamide
CID 107631780
2-amino-N-(2-bromo-6-chloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide
CID 107616628
2-amino-N-(2-bromo-4-cyanophenyl)-6-ethylpyridine-4-carboxamide
CID 107793724
(2S)-2-amino-N-(2-bromo-5-fluorophenyl)butanamide
CID 103794714
3-amino-N-(2-bromo-5-fluorophenyl)-4,5-dichlorobenzamide
CID 107624291
2-amino-N-(3-bromo-2-methylphenyl)-6-propylpyridine-4-carboxamide
CID 107631129
6-bromo-N-(2-bromo-5-fluorophenyl)pyridine-3-carboxamide
CID 103753509
N-(2-bromo-5-fluorophenyl)-3-chloro-5-methylbenzamide
CID 103774481
2-amino-N-(2-bromo-5-chlorophenyl)-6-chloropyridine-4-carboxamide
CID 81275531
4-amino-N-(2-bromo-5-fluorophenyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 107624248
4-amino-N-(2-bromo-5-fluorophenyl)-1-ethylpyrazole-3-carboxamide
CID 107624222
N-(2-bromo-5-fluorophenyl)-4-fluoro-3-methylbenzamide
CID 103753535

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide (CID 107631716) is 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide is CCc1cc(C(=O)Nc2cc(F)ccc2Br)cc(N)n1.
What is the InChIKey of 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The InChIKey is OWMCFUYWGCTJSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrFN3O/c1-2-10-5-8(6-13(17)18-10)14(20)19-12-7-9(16)3-4-11(12)15/h3-7H,2H2,1H3,(H2,17,18)(H,19,20).
What are the key properties of 2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide?
2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide has a molecular weight of 338.18 g/mol, XLogP of 3.38, 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-5-fluorophenyl)-6-ethylpyridine-4-carboxamide is sourced from PubChem (CID 107631716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).