2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide

C15H16BrN3O — CID 62161411

IUPAC2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide
SMILESCCN(C(=O)c1cc(Br)cnc1N)c1ccc(C)cc1
InChIInChI=1S/C15H16BrN3O/c1-3-19(12-6-4-10(2)5-7-12)15(20)13-8-11(16)9-18-14(13)17/h4-9H,3H2,1-2H3,(H2,17,18)
InChIKeyZJAZXEBCJYGILL-UHFFFAOYSA-N
MW334.22 g/mol
LogP3.40
Rot. Bonds3

About 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide

2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide (PubChem CID 62161411) has the molecular formula C15H16BrN3O and a molecular weight of 334.22 g/mol. Its IUPAC name is 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide
PubChem CID62161411
Molecular FormulaC15H16BrN3O
Molecular Weight334.22 g/mol
Exact Mass333.05
IUPAC Name2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide
SMILESCCN(C(=O)c1cc(Br)cnc1N)c1ccc(C)cc1
InChIInChI=1S/C15H16BrN3O/c1-3-19(12-6-4-10(2)5-7-12)15(20)13-8-11(16)9-18-14(13)17/h4-9H,3H2,1-2H3,(H2,17,18)
InChIKeyZJAZXEBCJYGILL-UHFFFAOYSA-N
XLogP3.40
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.22
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-5-chloro-N-ethyl-N-(4-methylphenyl)pyridine-4-carboxamide
CID 114922711
5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62236094
5-bromo-2-chloro-N-ethyl-N-pyridin-4-ylpyridine-3-carboxamide
CID 113236092
5-bromo-N-ethyl-2-hydrazinyl-N-pyridin-4-ylpyridine-3-carboxamide
CID 106937594
2-amino-5-bromo-N-ethyl-N-(2-ethylbutyl)pyridine-3-carboxamide
CID 55041522
6-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide
CID 66463938
2-amino-5-bromo-N-cyclopentyl-N-ethylpyridine-3-carboxamide
CID 62153959
5-amino-N-ethyl-2,4-difluoro-N-(4-methylphenyl)benzamide
CID 62002734
N-(4-aminophenyl)-5-bromo-N-ethylpyridine-3-carboxamide
CID 63230213
N-ethyl-5-methyl-N-(4-methylphenyl)-1H-pyrazole-4-carboxamide
CID 63998232
2-amino-5-bromo-N-(2,2-dimethylpropyl)-N-methylpyridine-3-carboxamide
CID 62187326
3-bromo-5-chloro-N-ethyl-N-(4-methylphenyl)benzamide
CID 107952307

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide (CID 62161411) is 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide is CCN(C(=O)c1cc(Br)cnc1N)c1ccc(C)cc1.
What is the InChIKey of 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide?
The InChIKey is ZJAZXEBCJYGILL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrN3O/c1-3-19(12-6-4-10(2)5-7-12)15(20)13-8-11(16)9-18-14(13)17/h4-9H,3H2,1-2H3,(H2,17,18).
What are the key properties of 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide?
2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide has a molecular weight of 334.22 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 62161411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).