2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide

C21H19ClN2O2 — CID 39559750

IUPAC2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide
SMILESO=C(NCCc1cccnc1)c1ccccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C21H19ClN2O2/c22-18-9-7-17(8-10-18)15-26-20-6-2-1-5-19(20)21(25)24-13-11-16-4-3-12-23-14-16/h1-10,12,14H,11,13,15H2,(H,24,25)
InChIKeyPZQORIATXQMRFP-UHFFFAOYSA-N
MW366.85 g/mol
LogP4.29
Rot. Bonds7

About 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide

2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide (PubChem CID 39559750) has the molecular formula C21H19ClN2O2 and a molecular weight of 366.85 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide
PubChem CID39559750
Molecular FormulaC21H19ClN2O2
Molecular Weight366.85 g/mol
Exact Mass366.11
IUPAC Name2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide
SMILESO=C(NCCc1cccnc1)c1ccccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C21H19ClN2O2/c22-18-9-7-17(8-10-18)15-26-20-6-2-1-5-19(20)21(25)24-13-11-16-4-3-12-23-14-16/h1-10,12,14H,11,13,15H2,(H,24,25)
InChIKeyPZQORIATXQMRFP-UHFFFAOYSA-N
XLogP4.29
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.85
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide 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-[(4-chlorophenyl)methoxy]-N-(pyridin-3-ylmethyl)benzamide
CID 27554596
2-[(4-fluorophenyl)methoxy]-N-(pyridin-3-ylmethyl)benzamide
CID 8851794
2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide
CID 39561684
2-[(4-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
CID 9402900
2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 62072665
2-[(4-chlorophenyl)methoxy]-N-[2-(2-methylpropoxy)ethyl]benzamide
CID 60533123
2-chloro-N-[2-(4-chlorophenyl)ethyl]pyridine-3-carboxamide
CID 26711708
2-anilino-N-(2-pyridin-3-ylethyl)benzamide
CID 36866409
2-ethoxy-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 39561652
2-[(4-chlorophenyl)methoxy]-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide
CID 16573030
2-(methylamino)-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 62180569
N-benzyl-2-[[4-[[2-(benzylcarbamoyl)phenoxy]methyl]phenyl]methoxy]benzamide
CID 101339913

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide?
The IUPAC name of 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide (CID 39559750) is 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide.
What is the SMILES notation for 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide?
The canonical SMILES for 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide is O=C(NCCc1cccnc1)c1ccccc1OCc1ccc(Cl)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide?
The InChIKey is PZQORIATXQMRFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O2/c22-18-9-7-17(8-10-18)15-26-20-6-2-1-5-19(20)21(25)24-13-11-16-4-3-12-23-14-16/h1-10,12,14H,11,13,15H2,(H,24,25).
What are the key properties of 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide?
2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide has a molecular weight of 366.85 g/mol, XLogP of 4.29, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methoxy]-N-(2-pyridin-3-ylethyl)benzamide is sourced from PubChem (CID 39559750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).