N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide

C14H11Cl3N2O — CID 29294726

IUPACN-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide
SMILESO=C(CNc1ccc(Cl)c(Cl)c1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H11Cl3N2O/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)
InChIKeyAQTLDBAGQIJAIL-UHFFFAOYSA-N
MW329.61 g/mol
LogP4.70
Rot. Bonds4

About N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide

N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide (PubChem CID 29294726) has the molecular formula C14H11Cl3N2O and a molecular weight of 329.61 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide
PubChem CID29294726
Molecular FormulaC14H11Cl3N2O
Molecular Weight329.61 g/mol
Exact Mass327.99
IUPAC NameN-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide
SMILESO=C(CNc1ccc(Cl)c(Cl)c1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H11Cl3N2O/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)
InChIKeyAQTLDBAGQIJAIL-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

2-(4-chloroanilino)-N-(3,4-dichlorophenyl)acetamide
CID 54810250
2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide
CID 47313465
N-(4-acetamidophenyl)-2-(4-chloroanilino)acetamide
CID 2604426
2-(3,4-dichloroanilino)-N-(2,3,4-trifluorophenyl)acetamide
CID 109011156
2-(4-chloroanilino)-N-(3-chloro-4-methylphenyl)acetamide
CID 9098971
N-(3,4-dichlorophenyl)-2-(4-fluoro-3-nitroanilino)acetamide
CID 9099793
2-(3,4-dichloroanilino)-N-(3,5-dimethoxyphenyl)acetamide
CID 4796501
2-(4-chloro-3-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 60536545
2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide
CID 9080372
2-(3,4-dichloroanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9098792
2-(3,4-dichloroanilino)-N-pentan-3-ylacetamide
CID 60671364
2-(5-bromo-2-chloroanilino)-N-(4-chlorophenyl)acetamide
CID 63492462

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide (CID 29294726) is N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide is O=C(CNc1ccc(Cl)c(Cl)c1)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide?
The InChIKey is AQTLDBAGQIJAIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl3N2O/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 N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide?
N-(4-chlorophenyl)-2-(3,4-dichloroanilino)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 N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide is sourced from PubChem (CID 29294726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).