N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide

C15H13ClFNO — CID 9401009

IUPACN-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide
SMILESO=C(CCc1ccccc1F)Nc1ccccc1Cl
InChIInChI=1S/C15H13ClFNO/c16-12-6-2-4-8-14(12)18-15(19)10-9-11-5-1-3-7-13(11)17/h1-8H,9-10H2,(H,18,19)
InChIKeyIGHFNBAZJFUVJP-UHFFFAOYSA-N
MW277.73 g/mol
LogP4.05
Rot. Bonds4

About N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide

N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide (PubChem CID 9401009) has the molecular formula C15H13ClFNO and a molecular weight of 277.73 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide
PubChem CID9401009
Molecular FormulaC15H13ClFNO
Molecular Weight277.73 g/mol
Exact Mass277.07
IUPAC NameN-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide
SMILESO=C(CCc1ccccc1F)Nc1ccccc1Cl
InChIInChI=1S/C15H13ClFNO/c16-12-6-2-4-8-14(12)18-15(19)10-9-11-5-1-3-7-13(11)17/h1-8H,9-10H2,(H,18,19)
InChIKeyIGHFNBAZJFUVJP-UHFFFAOYSA-N
XLogP4.05
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.73
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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3-(2-chlorophenyl)-N-(2-hydroxyphenyl)propanamide
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3-(2-fluorophenyl)-N-[2-[[(2,2,2-trifluoroacetyl)amino]methyl]phenyl]propanamide
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N-(2-chlorophenyl)-N'-(2,6-difluorophenyl)propanediamide
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N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-3-(2-fluorophenyl)propanamide
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3-(2-chlorophenyl)-N-[2-(difluoromethylsulfanyl)phenyl]propanamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide?
The IUPAC name of N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide (CID 9401009) is N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide?
The canonical SMILES for N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide is O=C(CCc1ccccc1F)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide?
The InChIKey is IGHFNBAZJFUVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO/c16-12-6-2-4-8-14(12)18-15(19)10-9-11-5-1-3-7-13(11)17/h1-8H,9-10H2,(H,18,19).
What are the key properties of N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide?
N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide has a molecular weight of 277.73 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide is sourced from PubChem (CID 9401009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).