2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide

C22H19F2NO2 — CID 71781812

IUPAC2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide
SMILESCC(O)(CNC(=O)c1c(F)cccc1F)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C22H19F2NO2/c1-22(27,14-25-21(26)20-18(23)8-5-9-19(20)24)17-12-10-16(11-13-17)15-6-3-2-4-7-15/h2-13,27H,14H2,1H3,(H,25,26)
InChIKeyJNHGJNQTOPXXDF-UHFFFAOYSA-N
MW367.40 g/mol
LogP4.27
Rot. Bonds5

About 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide

2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide (PubChem CID 71781812) has the molecular formula C22H19F2NO2 and a molecular weight of 367.40 g/mol. Its IUPAC name is 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide
PubChem CID71781812
Molecular FormulaC22H19F2NO2
Molecular Weight367.40 g/mol
Exact Mass367.14
IUPAC Name2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide
SMILESCC(O)(CNC(=O)c1c(F)cccc1F)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C22H19F2NO2/c1-22(27,14-25-21(26)20-18(23)8-5-9-19(20)24)17-12-10-16(11-13-17)15-6-3-2-4-7-15/h2-13,27H,14H2,1H3,(H,25,26)
InChIKeyJNHGJNQTOPXXDF-UHFFFAOYSA-N
XLogP4.27
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.40
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide
CID 121085663
N'-(2-fluorophenyl)-N-[2-hydroxy-2-(4-phenylphenyl)propyl]oxamide
CID 90497596
N-[2-hydroxy-2-(4-phenylphenyl)propyl]-1,2-oxazole-5-carboxamide
CID 90497502
N-[(2S)-2-hydroxy-2-(4-phenylphenyl)propyl]-4-methoxybenzamide
CID 95982815
2,6-difluoro-N-[(2S)-2-hydroxy-2-thiophen-2-ylpropyl]benzamide
CID 95983276
N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2,5-dimethylfuran-3-carboxamide
CID 71781805
N'-(3,4-difluorophenyl)-N-[2-hydroxy-2-(4-phenylphenyl)propyl]oxamide
CID 90497618
N'-(3-fluorophenyl)-N-[2-hydroxy-2-(4-phenylphenyl)propyl]oxamide
CID 71781848
N-(2-hydroxy-2-phenylpropyl)-4-methylbenzamide
CID 110663962
N-[2-hydroxy-2-(4-phenylphenyl)propyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 71781801
3,4-difluoro-N-[(2S)-2-hydroxy-2-phenylpropyl]benzamide
CID 95367981
2,6-difluoro-N-(2-methoxy-2-phenylbutyl)benzamide
CID 71810728

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide?
The IUPAC name of 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide (CID 71781812) is 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide is CC(O)(CNC(=O)c1c(F)cccc1F)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide?
The InChIKey is JNHGJNQTOPXXDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19F2NO2/c1-22(27,14-25-21(26)20-18(23)8-5-9-19(20)24)17-12-10-16(11-13-17)15-6-3-2-4-7-15/h2-13,27H,14H2,1H3,(H,25,26).
What are the key properties of 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide?
2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide has a molecular weight of 367.40 g/mol, XLogP of 4.27, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide is sourced from PubChem (CID 71781812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).