2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide

C23H23NO2 — CID 32979372

IUPAC2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide
SMILESO=C(NCCCc1ccccc1)c1ccccc1COc1ccccc1
InChIInChI=1S/C23H23NO2/c25-23(24-17-9-12-19-10-3-1-4-11-19)22-16-8-7-13-20(22)18-26-21-14-5-2-6-15-21/h1-8,10-11,13-16H,9,12,17-18H2,(H,24,25)
InChIKeyOJQYVLKQIWWGMG-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.63
Rot. Bonds8

About 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide

2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide (PubChem CID 32979372) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide.

Molecular Properties

Compound Name2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide
PubChem CID32979372
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC Name2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide
SMILESO=C(NCCCc1ccccc1)c1ccccc1COc1ccccc1
InChIInChI=1S/C23H23NO2/c25-23(24-17-9-12-19-10-3-1-4-11-19)22-16-8-7-13-20(22)18-26-21-14-5-2-6-15-21/h1-8,10-11,13-16H,9,12,17-18H2,(H,24,25)
InChIKeyOJQYVLKQIWWGMG-UHFFFAOYSA-N
XLogP4.63
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(phenoxymethyl)-N-(3-phenylpropyl)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

N-[3-(methylamino)propyl]-2-(phenoxymethyl)benzamide
CID 119431897
N-[2-(4-fluorophenyl)ethyl]-2-(phenoxymethyl)benzamide
CID 32979164
N-[2-(2-fluorophenyl)ethyl]-2-(phenoxymethyl)benzamide
CID 24512894
benzyl 2-[[2-(phenoxymethyl)benzoyl]amino]acetate
CID 32982202
N-[2-[di(propan-2-yl)amino]ethyl]-2-(phenoxymethyl)benzamide
CID 39467394
2-(phenoxymethyl)-N-prop-2-enylbenzamide
CID 9399802
N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-2-(phenoxymethyl)benzamide
CID 35888051
N,N-diethyl-2-(phenoxymethyl)benzamide
CID 78777252
N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-2-(phenoxymethyl)benzamide
CID 86938722
2-[4-[2-[[2-(methoxymethyl)benzoyl]amino]ethyl]phenoxy]acetic acid
CID 119255595
N,N-dimethyl-2-(phenoxymethyl)benzamide
CID 134022314
2-(phenoxymethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 24512524

Frequently Asked Questions

What is the IUPAC name of 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide?
The IUPAC name of 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide (CID 32979372) is 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide.
What is the SMILES notation for 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide?
The canonical SMILES for 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide is O=C(NCCCc1ccccc1)c1ccccc1COc1ccccc1.
What is the InChIKey of 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide?
The InChIKey is OJQYVLKQIWWGMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c25-23(24-17-9-12-19-10-3-1-4-11-19)22-16-8-7-13-20(22)18-26-21-14-5-2-6-15-21/h1-8,10-11,13-16H,9,12,17-18H2,(H,24,25).
What are the key properties of 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide?
2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide has a molecular weight of 345.44 g/mol, XLogP of 4.63, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phenoxymethyl)-N-(3-phenylpropyl)benzamide is sourced from PubChem (CID 32979372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).