2-(3-fluoro-4-methylanilino)-2-phenylacetamide

C15H15FN2O — CID 47137894

IUPAC2-(3-fluoro-4-methylanilino)-2-phenylacetamide
SMILESCc1ccc(NC(C(N)=O)c2ccccc2)cc1F
InChIInChI=1S/C15H15FN2O/c1-10-7-8-12(9-13(10)16)18-14(15(17)19)11-5-3-2-4-6-11/h2-9,14,18H,1H3,(H2,17,19)
InChIKeyDCJDOURATDQUAK-UHFFFAOYSA-N
MW258.30 g/mol
LogP2.77
Rot. Bonds4

About 2-(3-fluoro-4-methylanilino)-2-phenylacetamide

2-(3-fluoro-4-methylanilino)-2-phenylacetamide (PubChem CID 47137894) has the molecular formula C15H15FN2O and a molecular weight of 258.30 g/mol. Its IUPAC name is 2-(3-fluoro-4-methylanilino)-2-phenylacetamide.

Molecular Properties

Compound Name2-(3-fluoro-4-methylanilino)-2-phenylacetamide
PubChem CID47137894
Molecular FormulaC15H15FN2O
Molecular Weight258.30 g/mol
Exact Mass258.12
IUPAC Name2-(3-fluoro-4-methylanilino)-2-phenylacetamide
SMILESCc1ccc(NC(C(N)=O)c2ccccc2)cc1F
InChIInChI=1S/C15H15FN2O/c1-10-7-8-12(9-13(10)16)18-14(15(17)19)11-5-3-2-4-6-11/h2-9,14,18H,1H3,(H2,17,19)
InChIKeyDCJDOURATDQUAK-UHFFFAOYSA-N
XLogP2.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluoroanilino)-2-(3-fluoro-4-methylphenyl)acetamide
CID 63649606
(2S)-2-(3,5-dimethylanilino)-2-phenylacetamide
CID 25348784
2-anilino-2-phenylacetamide;ethane
CID 142824395
(2R)-2-phenyl-2-(3-propan-2-ylanilino)acetamide
CID 33474317
2-(3,4-difluoroanilino)-2-phenylacetic acid
CID 70136310
(2R)-2-(3,4-dimethylanilino)-2-phenylacetic acid
CID 7148217
N-(3-fluoro-4-methylphenyl)-2,2-diphenylacetamide
CID 676006
(2S)-2-(4-ethylanilino)-2-phenylacetamide
CID 33403571
(2S)-2-(3-bromo-4-methoxyanilino)-2-phenylacetamide
CID 95623687
1-(3-fluoro-4-methylphenyl)-3-(1-phenylethyl)urea
CID 17087618
(2R)-2-(4-fluorophenyl)-2-(4-methylanilino)acetamide
CID 93381369
3-(3-fluoro-4-methylanilino)-3-(4-phenylphenyl)propanoic acid
CID 170945281

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-methylanilino)-2-phenylacetamide?
The IUPAC name of 2-(3-fluoro-4-methylanilino)-2-phenylacetamide (CID 47137894) is 2-(3-fluoro-4-methylanilino)-2-phenylacetamide.
What is the SMILES notation for 2-(3-fluoro-4-methylanilino)-2-phenylacetamide?
The canonical SMILES for 2-(3-fluoro-4-methylanilino)-2-phenylacetamide is Cc1ccc(NC(C(N)=O)c2ccccc2)cc1F.
What is the InChIKey of 2-(3-fluoro-4-methylanilino)-2-phenylacetamide?
The InChIKey is DCJDOURATDQUAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O/c1-10-7-8-12(9-13(10)16)18-14(15(17)19)11-5-3-2-4-6-11/h2-9,14,18H,1H3,(H2,17,19).
What are the key properties of 2-(3-fluoro-4-methylanilino)-2-phenylacetamide?
2-(3-fluoro-4-methylanilino)-2-phenylacetamide has a molecular weight of 258.30 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-methylanilino)-2-phenylacetamide is sourced from PubChem (CID 47137894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).