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

C22H20FNO — CID 9397387

IUPACN-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide
SMILESO=C(CCc1ccccc1F)Nc1ccccc1Cc1ccccc1
InChIInChI=1S/C22H20FNO/c23-20-12-6-4-10-18(20)14-15-22(25)24-21-13-7-5-11-19(21)16-17-8-2-1-3-9-17/h1-13H,14-16H2,(H,24,25)
InChIKeyOLYGJVLPCGSMBB-UHFFFAOYSA-N
MW333.41 g/mol
LogP4.99
Rot. Bonds6

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

N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide (PubChem CID 9397387) has the molecular formula C22H20FNO and a molecular weight of 333.41 g/mol. Its IUPAC name is N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide.

Molecular Properties

Compound NameN-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide
PubChem CID9397387
Molecular FormulaC22H20FNO
Molecular Weight333.41 g/mol
Exact Mass333.15
IUPAC NameN-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide
SMILESO=C(CCc1ccccc1F)Nc1ccccc1Cc1ccccc1
InChIInChI=1S/C22H20FNO/c23-20-12-6-4-10-18(20)14-15-22(25)24-21-13-7-5-11-19(21)16-17-8-2-1-3-9-17/h1-13H,14-16H2,(H,24,25)
InChIKeyOLYGJVLPCGSMBB-UHFFFAOYSA-N
XLogP4.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-fluoro-N-(4-fluorophenyl)benzamide
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Benzamide, N-(2-benzoylphenyl)-
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Frequently Asked Questions

What is the IUPAC name of N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide?
The IUPAC name of N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide (CID 9397387) is N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide.
What is the SMILES notation for N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide?
The canonical SMILES for N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide is O=C(CCc1ccccc1F)Nc1ccccc1Cc1ccccc1.
What is the InChIKey of N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide?
The InChIKey is OLYGJVLPCGSMBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FNO/c23-20-12-6-4-10-18(20)14-15-22(25)24-21-13-7-5-11-19(21)16-17-8-2-1-3-9-17/h1-13H,14-16H2,(H,24,25).
What are the key properties of N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide?
N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide has a molecular weight of 333.41 g/mol, XLogP of 4.99, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzylphenyl)-3-(2-fluorophenyl)propanamide is sourced from PubChem (CID 9397387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).