3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide

C18H19F2NO — CID 110279623

IUPAC3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide
SMILESCC(CNC(=O)CCc1ccccc1F)c1ccc(F)cc1
InChIInChI=1S/C18H19F2NO/c1-13(14-6-9-16(19)10-7-14)12-21-18(22)11-8-15-4-2-3-5-17(15)20/h2-7,9-10,13H,8,11-12H2,1H3,(H,21,22)
InChIKeyDFTZJOFPJURSCL-UHFFFAOYSA-N
MW303.35 g/mol
LogP3.82
Rot. Bonds6

About 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide

3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide (PubChem CID 110279623) has the molecular formula C18H19F2NO and a molecular weight of 303.35 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide
PubChem CID110279623
Molecular FormulaC18H19F2NO
Molecular Weight303.35 g/mol
Exact Mass303.14
IUPAC Name3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide
SMILESCC(CNC(=O)CCc1ccccc1F)c1ccc(F)cc1
InChIInChI=1S/C18H19F2NO/c1-13(14-6-9-16(19)10-7-14)12-21-18(22)11-8-15-4-2-3-5-17(15)20/h2-7,9-10,13H,8,11-12H2,1H3,(H,21,22)
InChIKeyDFTZJOFPJURSCL-UHFFFAOYSA-N
XLogP3.82
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.35
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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3-(2-aminophenyl)-N-[2-(4-fluorophenoxy)propyl]propanamide
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CID 120612427
3-(2-fluorophenyl)-N-[(2R)-pentan-2-yl]propanamide
CID 94133800
2-(4-fluorophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide
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3-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)propanamide
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(2S)-3-[3-(2,3-difluorophenyl)propanoylamino]-2-methylpropanoic acid
CID 97324559
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N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-(2-fluorophenyl)propanamide
CID 46685783

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide?
The IUPAC name of 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide (CID 110279623) is 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide is CC(CNC(=O)CCc1ccccc1F)c1ccc(F)cc1.
What is the InChIKey of 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide?
The InChIKey is DFTZJOFPJURSCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F2NO/c1-13(14-6-9-16(19)10-7-14)12-21-18(22)11-8-15-4-2-3-5-17(15)20/h2-7,9-10,13H,8,11-12H2,1H3,(H,21,22).
What are the key properties of 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide?
3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide has a molecular weight of 303.35 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-[2-(4-fluorophenyl)propyl]propanamide is sourced from PubChem (CID 110279623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).