2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide

C14H11Cl2FN2O — CID 47313465

IUPAC2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)c(F)c1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H11Cl2FN2O/c15-9-1-3-10(4-2-9)19-14(20)8-18-11-5-6-12(16)13(17)7-11/h1-7,18H,8H2,(H,19,20)
InChIKeyTWXIXHMZPPUWIZ-UHFFFAOYSA-N
MW313.16 g/mol
LogP4.18
Rot. Bonds4

About 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide

2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide (PubChem CID 47313465) has the molecular formula C14H11Cl2FN2O and a molecular weight of 313.16 g/mol. Its IUPAC name is 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide
PubChem CID47313465
Molecular FormulaC14H11Cl2FN2O
Molecular Weight313.16 g/mol
Exact Mass312.02
IUPAC Name2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)c(F)c1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H11Cl2FN2O/c15-9-1-3-10(4-2-9)19-14(20)8-18-11-5-6-12(16)13(17)7-11/h1-7,18H,8H2,(H,19,20)
InChIKeyTWXIXHMZPPUWIZ-UHFFFAOYSA-N
XLogP4.18
TPSA41.13 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 ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chloro-3-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 60536545
N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide
CID 29294726
2-(4-chloroanilino)-N-(3,4-difluorophenyl)acetamide
CID 9098972
2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide
CID 54810250
2-(3-chloro-5-fluoroanilino)-N-(4-chlorophenyl)acetamide
CID 107365048
N-(4-chloro-3-fluorophenyl)-2-(prop-2-enylamino)acetamide
CID 79285958
2-(3-chloro-4-fluoroanilino)-N-[4-(dimethylamino)phenyl]acetamide
CID 109008699
2-(3-chloro-4-fluoroanilino)-N-(4-cyanophenyl)acetamide
CID 9099605
N-(4-acetamidophenyl)-2-(4-chloroanilino)acetamide
CID 2604426
N-(4-chloro-3-fluorophenyl)-3-sulfanylpropanamide
CID 107025056
2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide
CID 9080372
2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide
CID 9099614

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide?
The IUPAC name of 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide (CID 47313465) is 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide.
What is the SMILES notation for 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide?
The canonical SMILES for 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide is O=C(CNc1ccc(Cl)c(F)c1)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide?
The InChIKey is TWXIXHMZPPUWIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2FN2O/c15-9-1-3-10(4-2-9)19-14(20)8-18-11-5-6-12(16)13(17)7-11/h1-7,18H,8H2,(H,19,20).
What are the key properties of 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide?
2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide has a molecular weight of 313.16 g/mol, XLogP of 4.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide is sourced from PubChem (CID 47313465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).