2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide

C14H11Cl3N2O — CID 54810250

IUPAC2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)cc1)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H11Cl3N2O/c15-9-1-3-10(4-2-9)18-8-14(20)19-11-5-6-12(16)13(17)7-11/h1-7,18H,8H2,(H,19,20)
InChIKeyOQGBTOVTNCKMPO-UHFFFAOYSA-N
MW329.61 g/mol
LogP4.70
Rot. Bonds4

About 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide

2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide (PubChem CID 54810250) has the molecular formula C14H11Cl3N2O and a molecular weight of 329.61 g/mol. Its IUPAC name is 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide
PubChem CID54810250
Molecular FormulaC14H11Cl3N2O
Molecular Weight329.61 g/mol
Exact Mass327.99
IUPAC Name2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)cc1)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H11Cl3N2O/c15-9-1-3-10(4-2-9)18-8-14(20)19-11-5-6-12(16)13(17)7-11/h1-7,18H,8H2,(H,19,20)
InChIKeyOQGBTOVTNCKMPO-UHFFFAOYSA-N
XLogP4.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.61
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide
CID 29294726
2-(4-chloroanilino)-N-(3-chloro-4-methylphenyl)acetamide
CID 9098971
2-(4-chloroanilino)-N-(3,4-difluorophenyl)acetamide
CID 9098972
N-(4-acetamidophenyl)-2-(4-chloroanilino)acetamide
CID 2604426
2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide
CID 47313465
N-(3,4-dichlorophenyl)-2-(4-fluoro-3-nitroanilino)acetamide
CID 9099793
[2-(3,4-dichloroanilino)-2-oxoethyl]carbamic acid
CID 71381636
N-(3,4-dichlorophenyl)-2-(2-fluoroanilino)acetamide
CID 9099109
2-[2-(4-chlorophenyl)ethylamino]-N-(3,4-dichlorophenyl)acetamide
CID 109002904
2-(3,4-dichloroanilino)-N-(2,3,4-trifluorophenyl)acetamide
CID 109011156
2-(4-acetylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 9079945
2-(3,4-dichloroanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9098792

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide?
The IUPAC name of 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide (CID 54810250) is 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide?
The canonical SMILES for 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide is O=C(CNc1ccc(Cl)cc1)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide?
The InChIKey is OQGBTOVTNCKMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl3N2O/c15-9-1-3-10(4-2-9)18-8-14(20)19-11-5-6-12(16)13(17)7-11/h1-7,18H,8H2,(H,19,20).
What are the key properties of 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide?
2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide has a molecular weight of 329.61 g/mol, XLogP of 4.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide is sourced from PubChem (CID 54810250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).