3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide

C20H24FNO2 — CID 71810752

IUPAC3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide
SMILESCCC(CNC(=O)CCc1ccccc1F)(OC)c1ccccc1
InChIInChI=1S/C20H24FNO2/c1-3-20(24-2,17-10-5-4-6-11-17)15-22-19(23)14-13-16-9-7-8-12-18(16)21/h4-12H,3,13-15H2,1-2H3,(H,22,23)
InChIKeyDUIAITJXAIGGFQ-UHFFFAOYSA-N
MW329.42 g/mol
LogP3.83
Rot. Bonds8

About 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide

3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide (PubChem CID 71810752) has the molecular formula C20H24FNO2 and a molecular weight of 329.42 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide
PubChem CID71810752
Molecular FormulaC20H24FNO2
Molecular Weight329.42 g/mol
Exact Mass329.18
IUPAC Name3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide
SMILESCCC(CNC(=O)CCc1ccccc1F)(OC)c1ccccc1
InChIInChI=1S/C20H24FNO2/c1-3-20(24-2,17-10-5-4-6-11-17)15-22-19(23)14-13-16-9-7-8-12-18(16)21/h4-12H,3,13-15H2,1-2H3,(H,22,23)
InChIKeyDUIAITJXAIGGFQ-UHFFFAOYSA-N
XLogP3.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide 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 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide?
The IUPAC name of 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide (CID 71810752) is 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide is CCC(CNC(=O)CCc1ccccc1F)(OC)c1ccccc1.
What is the InChIKey of 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide?
The InChIKey is DUIAITJXAIGGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO2/c1-3-20(24-2,17-10-5-4-6-11-17)15-22-19(23)14-13-16-9-7-8-12-18(16)21/h4-12H,3,13-15H2,1-2H3,(H,22,23).
What are the key properties of 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide?
3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide has a molecular weight of 329.42 g/mol, XLogP of 3.83, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-(2-methoxy-2-phenylbutyl)propanamide is sourced from PubChem (CID 71810752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).