3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide

C17H18FNO — CID 47112649

IUPAC3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide
SMILESCC(NC(=O)CCc1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C17H18FNO/c1-13(15-5-3-2-4-6-15)19-17(20)12-9-14-7-10-16(18)11-8-14/h2-8,10-11,13H,9,12H2,1H3,(H,19,20)
InChIKeyAZLWKBQFAWXMJV-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.64
Rot. Bonds5

About 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide

3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide (PubChem CID 47112649) has the molecular formula C17H18FNO and a molecular weight of 271.34 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide
PubChem CID47112649
Molecular FormulaC17H18FNO
Molecular Weight271.34 g/mol
Exact Mass271.14
IUPAC Name3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide
SMILESCC(NC(=O)CCc1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C17H18FNO/c1-13(15-5-3-2-4-6-15)19-17(20)12-9-14-7-10-16(18)11-8-14/h2-8,10-11,13H,9,12H2,1H3,(H,19,20)
InChIKeyAZLWKBQFAWXMJV-UHFFFAOYSA-N
XLogP3.64
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-ethylphenyl)ethyl]-3-(4-fluorophenyl)propanamide
CID 127122521
N-[(4-fluorophenyl)methyl]-N'-(1-phenylethyl)butanediamide
CID 3943943
3-[acetyl-[2-(4-fluorophenyl)ethyl]amino]-N-(1-phenylethyl)propanamide
CID 113121082
2-[3-(4-fluorophenyl)propanoylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 92540792
2-[3-(4-fluorophenyl)propanoylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 92540793
3-(4-fluorophenyl)-N-[(2R)-4-phenylbutan-2-yl]propanamide
CID 94870735
3-(4-fluorophenyl)-N-[(2S)-4-phenylbutan-2-yl]propanamide
CID 95901327
3-(4-fluorophenyl)-N-[1-(4-methylsulfonylphenyl)ethyl]propanamide
CID 18096269
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-phenylacetamide
CID 2713141
N-[1-(2,5-difluorophenyl)ethyl]-3-phenylpropanamide
CID 46591216
4-[3-(4-fluorophenyl)propanoylamino]-4-phenylbutanoic acid
CID 119201110
3-(3-aminophenyl)-N-[(1S)-1-(4-fluorophenyl)ethyl]propanamide
CID 115341627

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide (CID 47112649) is 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide is CC(NC(=O)CCc1ccc(F)cc1)c1ccccc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide?
The InChIKey is AZLWKBQFAWXMJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c1-13(15-5-3-2-4-6-15)19-17(20)12-9-14-7-10-16(18)11-8-14/h2-8,10-11,13H,9,12H2,1H3,(H,19,20).
What are the key properties of 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide?
3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide has a molecular weight of 271.34 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide is sourced from PubChem (CID 47112649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).