5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide

C19H14BrClN2O2 — CID 580694

IUPAC5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1cc(Br)ccc1OCc1ccccc1Cl
InChIInChI=1S/C19H14BrClN2O2/c20-14-7-8-18(25-12-13-4-1-2-6-17(13)21)16(10-14)19(24)23-15-5-3-9-22-11-15/h1-11H,12H2,(H,23,24)
InChIKeySANMNLWWCYVPQC-UHFFFAOYSA-N
MW417.69 g/mol
LogP5.33
Rot. Bonds5

About 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide

5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide (PubChem CID 580694) has the molecular formula C19H14BrClN2O2 and a molecular weight of 417.69 g/mol. Its IUPAC name is 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide
PubChem CID580694
Molecular FormulaC19H14BrClN2O2
Molecular Weight417.69 g/mol
Exact Mass415.99
IUPAC Name5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1cc(Br)ccc1OCc1ccccc1Cl
InChIInChI=1S/C19H14BrClN2O2/c20-14-7-8-18(25-12-13-4-1-2-6-17(13)21)16(10-14)19(24)23-15-5-3-9-22-11-15/h1-11H,12H2,(H,23,24)
InChIKeySANMNLWWCYVPQC-UHFFFAOYSA-N
XLogP5.33
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.69
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide 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

2-((2-ethylphenyl)methoxy)-N-(pyridin-3-yl)benzamide
CID 118911741
[2,4-Dibromo-6-[(pyridine-3-carbonylamino)methyl]phenyl] 2-chlorobenzoate
CID 134135384
5-chloro-N-(2-chloropyridin-3-yl)-2-methoxybenzamide
CID 3154652
2-phenoxy-N-pyridin-3-ylbenzamide
CID 876892
2-[2-(4-bromoanilino)-2-oxoethoxy]-N-(pyridin-2-ylmethyl)benzamide
CID 2092582
2-(benzyloxy)-5-chloro-N-pyridin-3-ylbenzamide
CID 6463365
2-(benzyloxy)-5-bromo-N-(pyridin-3-yl)benzamide
CID 36982503
5-Bromo-2-[(phenylmethyl)oxy]-N-4-pyridazinylbenzamide
CID 51357233
5-Bromo-2-[(1-phenylethyl)oxy]-N-3-pyridinylbenzamide
CID 51357512
5-Methyl-2-[(phenylmethyl)oxy]-N-3-pyridinylbenzamide
CID 67107177
5-bromo-2-([(3,4-difluorophenyl)methyl]oxy)-N-3-pyridinylbenzamide
CID 67107224
5-Bromo-2-{[(4-fluorophenyl)methyl]oxy}-N-3-pyridinylbenzamide
CID 67107237

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The IUPAC name of 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide (CID 580694) is 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide is O=C(Nc1cccnc1)c1cc(Br)ccc1OCc1ccccc1Cl.
What is the InChIKey of 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The InChIKey is SANMNLWWCYVPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14BrClN2O2/c20-14-7-8-18(25-12-13-4-1-2-6-17(13)21)16(10-14)19(24)23-15-5-3-9-22-11-15/h1-11H,12H2,(H,23,24).
What are the key properties of 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide has a molecular weight of 417.69 g/mol, XLogP of 5.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-[(2-chlorophenyl)methoxy]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 580694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).