2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide

C16H16F2N2O — CID 60996994

IUPAC2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide
SMILESCCC(Nc1ccc(F)cc1)(C(N)=O)c1ccc(F)cc1
InChIInChI=1S/C16H16F2N2O/c1-2-16(15(19)21,11-3-5-12(17)6-4-11)20-14-9-7-13(18)8-10-14/h3-10,20H,2H2,1H3,(H2,19,21)
InChIKeyWCJYAAYHUQRRBD-UHFFFAOYSA-N
MW290.31 g/mol
LogP3.17
Rot. Bonds5

About 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide

2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide (PubChem CID 60996994) has the molecular formula C16H16F2N2O and a molecular weight of 290.31 g/mol. Its IUPAC name is 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide.

Molecular Properties

Compound Name2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide
PubChem CID60996994
Molecular FormulaC16H16F2N2O
Molecular Weight290.31 g/mol
Exact Mass290.12
IUPAC Name2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide
SMILESCCC(Nc1ccc(F)cc1)(C(N)=O)c1ccc(F)cc1
InChIInChI=1S/C16H16F2N2O/c1-2-16(15(19)21,11-3-5-12(17)6-4-11)20-14-9-7-13(18)8-10-14/h3-10,20H,2H2,1H3,(H2,19,21)
InChIKeyWCJYAAYHUQRRBD-UHFFFAOYSA-N
XLogP3.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.31
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-chloroanilino)-2-(4-chlorophenyl)butanamide
CID 60992126
2-anilino-2-(4-methylphenyl)butanamide
CID 60996158
methyl 2-anilino-2-(4-fluorophenyl)butanoate
CID 60992178
2-(4-chloroanilino)-2-phenylbutanamide
CID 60991020
2-(3-chloroanilino)-2-(4-chlorophenyl)butanamide
CID 60996840
ethyl 2-(4-fluorophenyl)-2-(propan-2-ylamino)butanoate
CID 60786506
2-(4-fluorophenyl)-2-(2,2,2-trifluoroethylamino)butanoic acid
CID 54892938
ethyl 2-(4-fluorophenyl)-2-(2,2,2-trifluoroethylamino)butanoate
CID 60997637
2-(3-fluorophenyl)-2-(methylamino)butanamide
CID 114871926
2-(4-fluoroanilino)-2-methylbutan-1-ol
CID 61050548
2-(4-fluoroanilino)-3-methyl-2-phenylbutanamide
CID 60997141
2-(4-methylphenyl)-2-(propan-2-ylamino)butanamide
CID 60787687

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide?
The IUPAC name of 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide (CID 60996994) is 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide.
What is the SMILES notation for 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide?
The canonical SMILES for 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide is CCC(Nc1ccc(F)cc1)(C(N)=O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide?
The InChIKey is WCJYAAYHUQRRBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2O/c1-2-16(15(19)21,11-3-5-12(17)6-4-11)20-14-9-7-13(18)8-10-14/h3-10,20H,2H2,1H3,(H2,19,21).
What are the key properties of 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide?
2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide has a molecular weight of 290.31 g/mol, XLogP of 3.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoroanilino)-2-(4-fluorophenyl)butanamide is sourced from PubChem (CID 60996994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).