2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide

C15H12F3NO2 — CID 48571112

IUPAC2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)C(F)(F)c2ccc(F)cc2)c1
InChIInChI=1S/C15H12F3NO2/c1-21-13-4-2-3-12(9-13)19-14(20)15(17,18)10-5-7-11(16)8-6-10/h2-9H,1H3,(H,19,20)
InChIKeyQSUXZNIVVSMBOC-UHFFFAOYSA-N
MW295.26 g/mol
LogP3.56
Rot. Bonds4

About 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide

2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide (PubChem CID 48571112) has the molecular formula C15H12F3NO2 and a molecular weight of 295.26 g/mol. Its IUPAC name is 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide
PubChem CID48571112
Molecular FormulaC15H12F3NO2
Molecular Weight295.26 g/mol
Exact Mass295.08
IUPAC Name2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)C(F)(F)c2ccc(F)cc2)c1
InChIInChI=1S/C15H12F3NO2/c1-21-13-4-2-3-12(9-13)19-14(20)15(17,18)10-5-7-11(16)8-6-10/h2-9H,1H3,(H,19,20)
InChIKeyQSUXZNIVVSMBOC-UHFFFAOYSA-N
XLogP3.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.26
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)-N-(3-methoxyphenyl)-2-methylpropanamide
CID 113197444
N-(3-fluorophenyl)-N'-(3-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969376
2-hydroxy-N-(3-methoxyphenyl)-2,2-diphenylacetamide
CID 828005
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluoro-N-(3-methoxyphenyl)nonanamide
CID 3510887
8-chloro-2,2,3,3,4,4,5,5,6,6,7,7,8,8-tetradecafluoro-N-(3-methoxyphenyl)octanamide
CID 4621112
1-N-(4-fluorophenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057463
2,2,3,3,4,4,5,5-octafluoro-N-(3-methoxyphenyl)pentanamide
CID 4521751
2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide
CID 79809500
methane;N-(3-methoxyphenyl)acetamide
CID 161026095
N-(3-methoxyphenyl)-2-(trifluoromethyl)prop-2-enamide
CID 91220248
1-(3-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]thiourea
CID 976911
1-(3,5-dimethoxyphenyl)-3-[3-(trifluoromethyl)phenyl]urea
CID 971869

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide (CID 48571112) is 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)C(F)(F)c2ccc(F)cc2)c1.
What is the InChIKey of 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide?
The InChIKey is QSUXZNIVVSMBOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO2/c1-21-13-4-2-3-12(9-13)19-14(20)15(17,18)10-5-7-11(16)8-6-10/h2-9H,1H3,(H,19,20).
What are the key properties of 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide?
2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide has a molecular weight of 295.26 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 48571112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).