2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide

C14H10Cl3FN2O — CID 26437681

IUPAC2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide
SMILESO=C(CNc1ccc(F)c(Cl)c1)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H10Cl3FN2O/c15-8-1-4-13(11(17)5-8)20-14(21)7-19-9-2-3-12(18)10(16)6-9/h1-6,19H,7H2,(H,20,21)
InChIKeyJNIFFUSCVXPXNV-UHFFFAOYSA-N
MW347.60 g/mol
LogP4.84
Rot. Bonds4

About 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide

2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide (PubChem CID 26437681) has the molecular formula C14H10Cl3FN2O and a molecular weight of 347.60 g/mol. Its IUPAC name is 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide
PubChem CID26437681
Molecular FormulaC14H10Cl3FN2O
Molecular Weight347.60 g/mol
Exact Mass345.98
IUPAC Name2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide
SMILESO=C(CNc1ccc(F)c(Cl)c1)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H10Cl3FN2O/c15-8-1-4-13(11(17)5-8)20-14(21)7-19-9-2-3-12(18)10(16)6-9/h1-6,19H,7H2,(H,20,21)
InChIKeyJNIFFUSCVXPXNV-UHFFFAOYSA-N
XLogP4.84
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.60
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide?
The IUPAC name of 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide (CID 26437681) is 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide?
The canonical SMILES for 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide is O=C(CNc1ccc(F)c(Cl)c1)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide?
The InChIKey is JNIFFUSCVXPXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3FN2O/c15-8-1-4-13(11(17)5-8)20-14(21)7-19-9-2-3-12(18)10(16)6-9/h1-6,19H,7H2,(H,20,21).
What are the key properties of 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide?
2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide has a molecular weight of 347.60 g/mol, XLogP of 4.84, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide is sourced from PubChem (CID 26437681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).