2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide

C16H15F2NO2 — CID 105058990

IUPAC2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide
SMILESCC(CO)(NC(=O)c1c(F)cccc1F)c1ccccc1
InChIInChI=1S/C16H15F2NO2/c1-16(10-20,11-6-3-2-4-7-11)19-15(21)14-12(17)8-5-9-13(14)18/h2-9,20H,10H2,1H3,(H,19,21)
InChIKeyIQIDDXKVNFKVSM-UHFFFAOYSA-N
MW291.30 g/mol
LogP2.60
Rot. Bonds4

About 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide

2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide (PubChem CID 105058990) has the molecular formula C16H15F2NO2 and a molecular weight of 291.30 g/mol. Its IUPAC name is 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide
PubChem CID105058990
Molecular FormulaC16H15F2NO2
Molecular Weight291.30 g/mol
Exact Mass291.11
IUPAC Name2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide
SMILESCC(CO)(NC(=O)c1c(F)cccc1F)c1ccccc1
InChIInChI=1S/C16H15F2NO2/c1-16(10-20,11-6-3-2-4-7-11)19-15(21)14-12(17)8-5-9-13(14)18/h2-9,20H,10H2,1H3,(H,19,21)
InChIKeyIQIDDXKVNFKVSM-UHFFFAOYSA-N
XLogP2.60
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-chloro-2-phenylpropan-2-yl)-2,6-difluorobenzamide
CID 105059916
3-fluoro-N-(1-hydroxy-2-phenylpropan-2-yl)-4-methylbenzamide
CID 105058932
(1-hydroxy-2-phenylpropan-2-yl)urea
CID 105059189
N-(1-hydroxy-2-phenylpropan-2-yl)-2,3-dimethylbenzamide
CID 105058775
3-amino-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058260
N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058812
3-bromo-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105057894
N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide
CID 105060348
3,5-diamino-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide
CID 105057637
N-(1-hydroxy-2-phenylpropan-2-yl)pyridine-2-carboxamide
CID 105059023
(E)-N-(1-hydroxy-2-phenylpropan-2-yl)but-2-enamide
CID 105057886
1-(1-hydroxy-2-phenylpropan-2-yl)-3-(2,2,2-trifluoroethyl)urea
CID 115619743

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide?
The IUPAC name of 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide (CID 105058990) is 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide.
What is the SMILES notation for 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide?
The canonical SMILES for 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide is CC(CO)(NC(=O)c1c(F)cccc1F)c1ccccc1.
What is the InChIKey of 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide?
The InChIKey is IQIDDXKVNFKVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO2/c1-16(10-20,11-6-3-2-4-7-11)19-15(21)14-12(17)8-5-9-13(14)18/h2-9,20H,10H2,1H3,(H,19,21).
What are the key properties of 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide?
2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide has a molecular weight of 291.30 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide is sourced from PubChem (CID 105058990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).