4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide

C17H17F2NO2 — CID 90599067

IUPAC4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide
SMILESCOC(C)(CNC(=O)c1ccc(F)cc1)c1ccccc1F
InChIInChI=1S/C17H17F2NO2/c1-17(22-2,14-5-3-4-6-15(14)19)11-20-16(21)12-7-9-13(18)10-8-12/h3-10H,11H2,1-2H3,(H,20,21)
InChIKeyDCTVZLUKJNPOOD-UHFFFAOYSA-N
MW305.32 g/mol
LogP3.26
Rot. Bonds5

About 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide

4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide (PubChem CID 90599067) has the molecular formula C17H17F2NO2 and a molecular weight of 305.32 g/mol. Its IUPAC name is 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide
PubChem CID90599067
Molecular FormulaC17H17F2NO2
Molecular Weight305.32 g/mol
Exact Mass305.12
IUPAC Name4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide
SMILESCOC(C)(CNC(=O)c1ccc(F)cc1)c1ccccc1F
InChIInChI=1S/C17H17F2NO2/c1-17(22-2,14-5-3-4-6-15(14)19)11-20-16(21)12-7-9-13(18)10-8-12/h3-10H,11H2,1-2H3,(H,20,21)
InChIKeyDCTVZLUKJNPOOD-UHFFFAOYSA-N
XLogP3.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]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-[2-(2-fluorophenyl)-2-methoxypropyl]-4-(trifluoromethyl)benzamide
CID 90599146
1-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]-3-[(4-fluorophenyl)methyl]urea
CID 97428533
2-chloro-N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]benzamide
CID 97428331
N-[2-(2-fluorophenyl)-2-methoxypropyl]-2,1,3-benzothiadiazole-5-carboxamide
CID 71810626
N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide
CID 90599111
4-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]-3-nitrobenzamide
CID 90599164
ethyl N-[2-(2-fluorophenyl)-2-methoxypropyl]carbamate
CID 71810594
N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide
CID 90599092
2-ethoxy-N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]acetamide
CID 97428304
N-[2-(2-fluorophenyl)-2-methoxypropyl]-N'-propan-2-yloxamide
CID 90599312
N-benzyl-N'-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]oxamide
CID 97428501
2-(3,4-dimethoxyphenyl)-N-[2-(2-fluorophenyl)-2-methoxypropyl]acetamide
CID 90599157

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide?
The IUPAC name of 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide (CID 90599067) is 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide?
The canonical SMILES for 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide is COC(C)(CNC(=O)c1ccc(F)cc1)c1ccccc1F.
What is the InChIKey of 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide?
The InChIKey is DCTVZLUKJNPOOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F2NO2/c1-17(22-2,14-5-3-4-6-15(14)19)11-20-16(21)12-7-9-13(18)10-8-12/h3-10H,11H2,1-2H3,(H,20,21).
What are the key properties of 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide?
4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide has a molecular weight of 305.32 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide is sourced from PubChem (CID 90599067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).