2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide

C16H14Cl2N2O2 — CID 113171584

IUPAC2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cccc(Cl)c1)c1ccc(Cl)cc1
InChIInChI=1S/C16H14Cl2N2O2/c1-11(21)20(15-7-5-12(17)6-8-15)10-16(22)19-14-4-2-3-13(18)9-14/h2-9H,10H2,1H3,(H,19,22)
InChIKeyIEHGEFVMOBEARJ-UHFFFAOYSA-N
MW337.21 g/mol
LogP3.98
Rot. Bonds4

About 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide

2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide (PubChem CID 113171584) has the molecular formula C16H14Cl2N2O2 and a molecular weight of 337.21 g/mol. Its IUPAC name is 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide
PubChem CID113171584
Molecular FormulaC16H14Cl2N2O2
Molecular Weight337.21 g/mol
Exact Mass336.04
IUPAC Name2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cccc(Cl)c1)c1ccc(Cl)cc1
InChIInChI=1S/C16H14Cl2N2O2/c1-11(21)20(15-7-5-12(17)6-8-15)10-16(22)19-14-4-2-3-13(18)9-14/h2-9H,10H2,1H3,(H,19,22)
InChIKeyIEHGEFVMOBEARJ-UHFFFAOYSA-N
XLogP3.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.21
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-3-methylanilino)-N-(3-chlorophenyl)acetamide
CID 113167570
2-(N-acetyl-3-chloroanilino)-N-(3-methylphenyl)acetamide
CID 113171372
2-[N-acetyl-4-(dimethylamino)anilino]-N-(4-chlorophenyl)acetamide
CID 113176754
2-(N-acetyl-4-chloro-2-methylanilino)-N-(3-methylphenyl)acetamide
CID 113172074
2-[N-acetyl-2,6-di(propan-2-yl)anilino]-N-(3-chlorophenyl)acetamide
CID 113178608
2-(4-acetamido-N-acetylanilino)-N-(3,5-dichlorophenyl)acetamide
CID 113176021
2-(N-acetyl-2,4-dichloroanilino)-N-(3-fluorophenyl)acetamide
CID 113179657
2-(N-acetyl-4-chloroanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 113171587
2-(3-acetamido-N-acetylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 113175826
3-(N-acetyl-4-propan-2-ylanilino)-N-(3-chlorophenyl)propanamide
CID 113125911
2-[acetyl-(5-methyl-1,2-oxazol-3-yl)amino]-N-(3-chlorophenyl)acetamide
CID 113181857
2-(N-acetyl-3,5-dimethylanilino)-N-(4-chlorophenyl)acetamide
CID 113168546

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide (CID 113171584) is 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide is CC(=O)N(CC(=O)Nc1cccc(Cl)c1)c1ccc(Cl)cc1.
What is the InChIKey of 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide?
The InChIKey is IEHGEFVMOBEARJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O2/c1-11(21)20(15-7-5-12(17)6-8-15)10-16(22)19-14-4-2-3-13(18)9-14/h2-9H,10H2,1H3,(H,19,22).
What are the key properties of 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide?
2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide has a molecular weight of 337.21 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-chloroanilino)-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 113171584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).