2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide

C15H12FN3O — CID 61005173

IUPAC2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide
SMILESN#Cc1cccc(C(Nc2ccc(F)cc2)C(N)=O)c1
InChIInChI=1S/C15H12FN3O/c16-12-4-6-13(7-5-12)19-14(15(18)20)11-3-1-2-10(8-11)9-17/h1-8,14,19H,(H2,18,20)
InChIKeyBRFHYVFXMZRRMC-UHFFFAOYSA-N
MW269.28 g/mol
LogP2.34
Rot. Bonds4

About 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide

2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide (PubChem CID 61005173) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide.

Molecular Properties

Compound Name2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide
PubChem CID61005173
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide
SMILESN#Cc1cccc(C(Nc2ccc(F)cc2)C(N)=O)c1
InChIInChI=1S/C15H12FN3O/c16-12-4-6-13(7-5-12)19-14(15(18)20)11-3-1-2-10(8-11)9-17/h1-8,14,19H,(H2,18,20)
InChIKeyBRFHYVFXMZRRMC-UHFFFAOYSA-N
XLogP2.34
TPSA78.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluoroanilino)-2-(3-hydroxyphenyl)acetamide
CID 54892208
2-(2-chloroanilino)-2-(3-cyanophenyl)acetamide
CID 61006310
2-(3-cyanophenyl)-2-[2-(dimethylamino)ethylamino]acetamide
CID 54892385
2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide
CID 61005627
2-(4-fluoroanilino)-2-(3-fluoro-4-methylphenyl)acetamide
CID 63649606
(2R)-2-(4-fluorophenyl)-2-(4-methylanilino)acetamide
CID 93381369
2-(4-bromo-3-methylphenyl)-2-(4-fluoroanilino)acetamide
CID 66480971
2-(4-fluoroanilino)-2-(3-iodophenyl)acetic acid
CID 114283022
4-N-(3-cyanophenyl)-1-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049931
2-(5-bromo-2-fluorophenyl)-2-(4-fluoroanilino)acetamide
CID 61004958
2-anilino-2-[3-(trifluoromethyl)phenyl]acetamide
CID 61005725
2-(3-fluoro-5-methylanilino)-2-(3-hydroxyphenyl)acetamide
CID 79055466

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide?
The IUPAC name of 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide (CID 61005173) is 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide.
What is the SMILES notation for 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide?
The canonical SMILES for 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide is N#Cc1cccc(C(Nc2ccc(F)cc2)C(N)=O)c1.
What is the InChIKey of 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide?
The InChIKey is BRFHYVFXMZRRMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c16-12-4-6-13(7-5-12)19-14(15(18)20)11-3-1-2-10(8-11)9-17/h1-8,14,19H,(H2,18,20).
What are the key properties of 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide?
2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide has a molecular weight of 269.28 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide is sourced from PubChem (CID 61005173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).