2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide

C23H21F2NO2 — CID 56522955

IUPAC2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide
SMILESCC(NC(=O)Cc1ccc(OC(F)F)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H21F2NO2/c1-23(18-8-4-2-5-9-18,19-10-6-3-7-11-19)26-21(27)16-17-12-14-20(15-13-17)28-22(24)25/h2-15,22H,16H2,1H3,(H,26,27)
InChIKeyIXWCNTGMQDBOLU-UHFFFAOYSA-N
MW381.42 g/mol
LogP4.91
Rot. Bonds7

About 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide

2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide (PubChem CID 56522955) has the molecular formula C23H21F2NO2 and a molecular weight of 381.42 g/mol. Its IUPAC name is 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide.

Molecular Properties

Compound Name2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide
PubChem CID56522955
Molecular FormulaC23H21F2NO2
Molecular Weight381.42 g/mol
Exact Mass381.15
IUPAC Name2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide
SMILESCC(NC(=O)Cc1ccc(OC(F)F)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H21F2NO2/c1-23(18-8-4-2-5-9-18,19-10-6-3-7-11-19)26-21(27)16-17-12-14-20(15-13-17)28-22(24)25/h2-15,22H,16H2,1H3,(H,26,27)
InChIKeyIXWCNTGMQDBOLU-UHFFFAOYSA-N
XLogP4.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.42
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(difluoromethoxy)phenyl]-N-(4-hydroxy-2-methylbutan-2-yl)acetamide
CID 115870205
2-[4-(difluoromethoxy)phenyl]-N-(2-hydroxy-2-methylpropyl)acetamide
CID 65109978
2-[4-(difluoromethoxy)phenyl]-N-[(2-methylphenyl)methyl]acetamide
CID 33181859
2-[4-(difluoromethoxy)phenyl]acetic acid
CID 2774127
2-[4-(difluoromethoxy)phenyl]-1-phenylethanone
CID 86101125
N-(1-amino-2,4-dimethylpentan-2-yl)-2-[4-(difluoromethoxy)phenyl]acetamide;hydrochloride
CID 119598620
2-(4-fluorophenyl)-N-(2-phenylpropan-2-yl)acetamide
CID 13118330
2-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)acetamide
CID 33142215
2-[4-(difluoromethoxy)phenyl]-N-[(2R)-2-hydroxypropyl]acetamide
CID 83031888
2-[3-(difluoromethoxy)phenyl]-N-(2-hydroxy-2-phenylpropyl)acetamide
CID 111334767
2-[4-(difluoromethoxy)phenyl]-N-prop-2-ynylacetamide
CID 78808200
N-(4-acetamidophenyl)-2-[4-(difluoromethoxy)phenyl]acetamide
CID 35049094

Frequently Asked Questions

What is the IUPAC name of 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide?
The IUPAC name of 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide (CID 56522955) is 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide.
What is the SMILES notation for 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide?
The canonical SMILES for 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide is CC(NC(=O)Cc1ccc(OC(F)F)cc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide?
The InChIKey is IXWCNTGMQDBOLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21F2NO2/c1-23(18-8-4-2-5-9-18,19-10-6-3-7-11-19)26-21(27)16-17-12-14-20(15-13-17)28-22(24)25/h2-15,22H,16H2,1H3,(H,26,27).
What are the key properties of 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide?
2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide has a molecular weight of 381.42 g/mol, XLogP of 4.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethoxy)phenyl]-N-(1,1-diphenylethyl)acetamide is sourced from PubChem (CID 56522955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).