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

C15H15BrN2O2 — CID 47312097

IUPAC5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2cncc(Br)c2)c(C)c1
InChIInChI=1S/C15H15BrN2O2/c1-3-20-13-4-5-14(10(2)6-13)18-15(19)11-7-12(16)9-17-8-11/h4-9H,3H2,1-2H3,(H,18,19)
InChIKeyWEXWAYOCPPUCQQ-UHFFFAOYSA-N
MW335.20 g/mol
LogP3.80
Rot. Bonds4

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

5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide (PubChem CID 47312097) has the molecular formula C15H15BrN2O2 and a molecular weight of 335.20 g/mol. Its IUPAC name is 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide
PubChem CID47312097
Molecular FormulaC15H15BrN2O2
Molecular Weight335.20 g/mol
Exact Mass334.03
IUPAC Name5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2cncc(Br)c2)c(C)c1
InChIInChI=1S/C15H15BrN2O2/c1-3-20-13-4-5-14(10(2)6-13)18-15(19)11-7-12(16)9-17-8-11/h4-9H,3H2,1-2H3,(H,18,19)
InChIKeyWEXWAYOCPPUCQQ-UHFFFAOYSA-N
XLogP3.80
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.20
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-bromo-N-(4-ethoxy-2-methylphenyl)benzamide
CID 47267913
5-bromo-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 835761
5-bromo-N-(3-ethoxyphenyl)pyridine-3-carboxamide
CID 61061483
5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide
CID 43806322
3-chloro-N-(4-ethoxy-2-methylphenyl)pyridine-4-carboxamide
CID 66465000
[4-[(4-ethoxybenzoyl)amino]-3-methylphenyl] 4-ethoxybenzoate
CID 1234586
5-bromo-N-[1-(4-ethoxyphenyl)ethyl]pyridine-3-carboxamide
CID 51292691
4-ethoxy-N-(4-iodo-2-methylphenyl)benzamide
CID 1350175
3-amino-4-chloro-N-(4-ethoxy-2-methylphenyl)benzamide
CID 60928289
methyl 2-[4-[(4-bromobenzoyl)amino]-3-methylphenoxy]acetate
CID 55916233
6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide
CID 61041819
4-amino-N-(4-ethoxy-2-methylphenyl)-1H-pyrazole-5-carboxamide
CID 63103395

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide (CID 47312097) is 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide is CCOc1ccc(NC(=O)c2cncc(Br)c2)c(C)c1.
What is the InChIKey of 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide?
The InChIKey is WEXWAYOCPPUCQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O2/c1-3-20-13-4-5-14(10(2)6-13)18-15(19)11-7-12(16)9-17-8-11/h4-9H,3H2,1-2H3,(H,18,19).
What are the key properties of 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide?
5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide has a molecular weight of 335.20 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 47312097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).