6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide

C20H17BrN2O3 — CID 55699313

IUPAC6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(Oc2cccc(Br)c2)nc1
InChIInChI=1S/C20H17BrN2O3/c1-2-25-18-9-4-3-8-17(18)23-20(24)14-10-11-19(22-13-14)26-16-7-5-6-15(21)12-16/h3-13H,2H2,1H3,(H,23,24)
InChIKeyFDNQHWZVSUTDCU-UHFFFAOYSA-N
MW413.27 g/mol
LogP5.29
Rot. Bonds6

About 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide

6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide (PubChem CID 55699313) has the molecular formula C20H17BrN2O3 and a molecular weight of 413.27 g/mol. Its IUPAC name is 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
PubChem CID55699313
Molecular FormulaC20H17BrN2O3
Molecular Weight413.27 g/mol
Exact Mass412.04
IUPAC Name6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(Oc2cccc(Br)c2)nc1
InChIInChI=1S/C20H17BrN2O3/c1-2-25-18-9-4-3-8-17(18)23-20(24)14-10-11-19(22-13-14)26-16-7-5-6-15(21)12-16/h3-13H,2H2,1H3,(H,23,24)
InChIKeyFDNQHWZVSUTDCU-UHFFFAOYSA-N
XLogP5.29
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.27
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)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

6-(3-bromophenoxy)-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 46458349
6-(3-bromophenoxy)-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 46459917
6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide
CID 60562203
6-(3-bromophenoxy)-N-[2-(cyclopropylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 46486838
6-(3-bromophenoxy)-N-(1-hydroxypropan-2-yl)pyridine-3-carboxamide
CID 78887929
3-bromo-N-[2-(2-ethoxyethoxy)phenyl]benzamide
CID 54790974
(2R)-2-(3-bromophenoxy)-N-(2-ethoxyphenyl)propanamide
CID 1177379
2-(3-bromophenoxy)-N-(2-ethoxyphenyl)propanamide
CID 3670954
6-(3-bromophenoxy)-N'-(2-chlorobenzoyl)pyridine-3-carbohydrazide
CID 55706653
N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 7311959
N-[3-[[acetyl(methyl)amino]methyl]phenyl]-6-(3-bromophenoxy)pyridine-3-carboxamide
CID 55706261
6-(3-bromophenoxy)-N-(3-nitrophenyl)pyridine-3-carboxamide
CID 46458129

Frequently Asked Questions

What is the IUPAC name of 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide (CID 55699313) is 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide is CCOc1ccccc1NC(=O)c1ccc(Oc2cccc(Br)c2)nc1.
What is the InChIKey of 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The InChIKey is FDNQHWZVSUTDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17BrN2O3/c1-2-25-18-9-4-3-8-17(18)23-20(24)14-10-11-19(22-13-14)26-16-7-5-6-15(21)12-16/h3-13H,2H2,1H3,(H,23,24).
What are the key properties of 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide has a molecular weight of 413.27 g/mol, XLogP of 5.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 55699313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).