2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide

C16H16ClN3O2 — CID 163304116

IUPAC2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide
SMILESCC(=O)Nc1ccccc1NCC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H16ClN3O2/c1-11(21)19-15-5-3-2-4-14(15)18-10-16(22)20-13-8-6-12(17)7-9-13/h2-9,18H,10H2,1H3,(H,19,21)(H,20,22)
InChIKeyGMDWMZASSHJIQD-UHFFFAOYSA-N
MW317.78 g/mol
LogP3.35
Rot. Bonds5

About 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide

2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide (PubChem CID 163304116) has the molecular formula C16H16ClN3O2 and a molecular weight of 317.78 g/mol. Its IUPAC name is 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide
PubChem CID163304116
Molecular FormulaC16H16ClN3O2
Molecular Weight317.78 g/mol
Exact Mass317.09
IUPAC Name2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide
SMILESCC(=O)Nc1ccccc1NCC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H16ClN3O2/c1-11(21)19-15-5-3-2-4-14(15)18-10-16(22)20-13-8-6-12(17)7-9-13/h2-9,18H,10H2,1H3,(H,19,21)(H,20,22)
InChIKeyGMDWMZASSHJIQD-UHFFFAOYSA-N
XLogP3.35
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.78
LogP ≤ 53.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-(4-chloroanilino)acetamide
CID 2604426
N-(4-chlorophenyl)-2-(2,3-dichloroanilino)acetamide
CID 29039257
N-(4-chlorophenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]amino]benzamide
CID 18205586
N-(4-acetamidophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54816111
2-(2-butoxyanilino)-N-(4-chlorophenyl)acetamide
CID 54827839
N-[4-[[2-(2-chloroanilino)acetyl]amino]phenyl]propanamide
CID 54810223
N-(4-chlorophenyl)-2-[2-(difluoromethylsulfonyl)anilino]acetamide
CID 133298392
2-[[2-(3-acetylanilino)-2-oxoethyl]amino]-N-(4-chlorophenyl)benzamide
CID 18228642
N-(4-chlorophenyl)-2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]benzamide
CID 9084498
N-[4-[[2-(2-chloroanilino)acetyl]amino]phenyl]butanamide
CID 54810199
2-(5-bromo-2-chloroanilino)-N-(4-chlorophenyl)acetamide
CID 63492462
2-(2-methylanilino)-N-(4-methylphenyl)acetamide
CID 7636705

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide?
The IUPAC name of 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide (CID 163304116) is 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide.
What is the SMILES notation for 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide?
The canonical SMILES for 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide is CC(=O)Nc1ccccc1NCC(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide?
The InChIKey is GMDWMZASSHJIQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O2/c1-11(21)19-15-5-3-2-4-14(15)18-10-16(22)20-13-8-6-12(17)7-9-13/h2-9,18H,10H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide?
2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide has a molecular weight of 317.78 g/mol, XLogP of 3.35, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetamidoanilino)-N-(4-chlorophenyl)acetamide is sourced from PubChem (CID 163304116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).