2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide

C14H10Cl4N2O — CID 54811499

IUPAC2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H10Cl4N2O/c15-8-1-3-12(10(17)5-8)19-7-14(21)20-13-4-2-9(16)6-11(13)18/h1-6,19H,7H2,(H,20,21)
InChIKeySKHGNSASBUDKES-UHFFFAOYSA-N
MW364.06 g/mol
LogP5.35
Rot. Bonds4

About 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide

2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide (PubChem CID 54811499) has the molecular formula C14H10Cl4N2O and a molecular weight of 364.06 g/mol. Its IUPAC name is 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide
PubChem CID54811499
Molecular FormulaC14H10Cl4N2O
Molecular Weight364.06 g/mol
Exact Mass361.95
IUPAC Name2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H10Cl4N2O/c15-8-1-3-12(10(17)5-8)19-7-14(21)20-13-4-2-9(16)6-11(13)18/h1-6,19H,7H2,(H,20,21)
InChIKeySKHGNSASBUDKES-UHFFFAOYSA-N
XLogP5.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.06
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide?
The IUPAC name of 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide (CID 54811499) is 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide?
The canonical SMILES for 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide is O=C(CNc1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide?
The InChIKey is SKHGNSASBUDKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl4N2O/c15-8-1-3-12(10(17)5-8)19-7-14(21)20-13-4-2-9(16)6-11(13)18/h1-6,19H,7H2,(H,20,21).
What are the key properties of 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide?
2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide has a molecular weight of 364.06 g/mol, XLogP of 5.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide is sourced from PubChem (CID 54811499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).