2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide

C14H11Cl2FN2O — CID 61005627

IUPAC2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide
SMILESNC(=O)C(Nc1ccc(F)cc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl2FN2O/c15-9-5-8(6-10(16)7-9)13(14(18)20)19-12-3-1-11(17)2-4-12/h1-7,13,19H,(H2,18,20)
InChIKeyMPVHHWLEOVDLLZ-UHFFFAOYSA-N
MW313.16 g/mol
LogP3.77
Rot. Bonds4

About 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide

2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide (PubChem CID 61005627) has the molecular formula C14H11Cl2FN2O and a molecular weight of 313.16 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide
PubChem CID61005627
Molecular FormulaC14H11Cl2FN2O
Molecular Weight313.16 g/mol
Exact Mass312.02
IUPAC Name2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide
SMILESNC(=O)C(Nc1ccc(F)cc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl2FN2O/c15-9-5-8(6-10(16)7-9)13(14(18)20)19-12-3-1-11(17)2-4-12/h1-7,13,19H,(H2,18,20)
InChIKeyMPVHHWLEOVDLLZ-UHFFFAOYSA-N
XLogP3.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.16
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(4-fluorophenyl)-2-(4-methylanilino)acetamide
CID 93381369
2-(4-fluoroanilino)-2-(3-hydroxyphenyl)acetamide
CID 54892208
2-(4-fluoroanilino)-2-(3-fluoro-4-methylphenyl)acetamide
CID 63649606
2-(3-bromo-4-chloroanilino)-2-(3,5-difluorophenyl)acetamide
CID 106528880
2-(4-bromo-3-methylphenyl)-2-(4-fluoroanilino)acetamide
CID 66480971
2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)ethanol
CID 61048365
2-(5-bromo-2-fluorophenyl)-2-(4-fluoroanilino)acetamide
CID 61004958
2-(3-cyanophenyl)-2-(4-fluoroanilino)acetamide
CID 61005173
(2R)-2-(4-chlorophenyl)-2-(4-fluoroanilino)acetic acid
CID 7152583
2-(3-chloro-4-fluorophenyl)-2-(4-methoxyanilino)acetamide
CID 81146886
2-(4-fluorophenyl)-2-(4-pentylanilino)acetamide
CID 78836194
2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide
CID 81146753

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide?
The IUPAC name of 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide (CID 61005627) is 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide.
What is the SMILES notation for 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide?
The canonical SMILES for 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide is NC(=O)C(Nc1ccc(F)cc1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide?
The InChIKey is MPVHHWLEOVDLLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2FN2O/c15-9-5-8(6-10(16)7-9)13(14(18)20)19-12-3-1-11(17)2-4-12/h1-7,13,19H,(H2,18,20).
What are the key properties of 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide?
2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide has a molecular weight of 313.16 g/mol, XLogP of 3.77, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide is sourced from PubChem (CID 61005627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).