N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide

C22H20FNO2 — CID 4852866

IUPACN-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide
SMILESCN(Cc1ccc(F)cc1)C(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C22H20FNO2/c1-24(15-17-10-12-20(23)13-11-17)22(25)19-8-5-9-21(14-19)26-16-18-6-3-2-4-7-18/h2-14H,15-16H2,1H3
InChIKeyURIJDJJBECYGSA-UHFFFAOYSA-N
MW349.41 g/mol
LogP4.68
Rot. Bonds6

About N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide

N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide (PubChem CID 4852866) has the molecular formula C22H20FNO2 and a molecular weight of 349.41 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide
PubChem CID4852866
Molecular FormulaC22H20FNO2
Molecular Weight349.41 g/mol
Exact Mass349.15
IUPAC NameN-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide
SMILESCN(Cc1ccc(F)cc1)C(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C22H20FNO2/c1-24(15-17-10-12-20(23)13-11-17)22(25)19-8-5-9-21(14-19)26-16-18-6-3-2-4-7-18/h2-14H,15-16H2,1H3
InChIKeyURIJDJJBECYGSA-UHFFFAOYSA-N
XLogP4.68
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide (CID 4852866) is N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide is CN(Cc1ccc(F)cc1)C(=O)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide?
The InChIKey is URIJDJJBECYGSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FNO2/c1-24(15-17-10-12-20(23)13-11-17)22(25)19-8-5-9-21(14-19)26-16-18-6-3-2-4-7-18/h2-14H,15-16H2,1H3.
What are the key properties of N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide?
N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide has a molecular weight of 349.41 g/mol, XLogP of 4.68, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide is sourced from PubChem (CID 4852866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).