2-(2-acetyl-4-chloro-5-methylanilino)acetamide

C11H13ClN2O2 — CID 141175373

IUPAC2-(2-acetyl-4-chloro-5-methylanilino)acetamide
SMILESCC(=O)c1cc(Cl)c(C)cc1NCC(N)=O
InChIInChI=1S/C11H13ClN2O2/c1-6-3-10(14-5-11(13)16)8(7(2)15)4-9(6)12/h3-4,14H,5H2,1-2H3,(H2,13,16)
InChIKeyGTFWLMMIEYASCW-UHFFFAOYSA-N
MW240.69 g/mol
LogP1.75
Rot. Bonds4

About 2-(2-acetyl-4-chloro-5-methylanilino)acetamide

2-(2-acetyl-4-chloro-5-methylanilino)acetamide (PubChem CID 141175373) has the molecular formula C11H13ClN2O2 and a molecular weight of 240.69 g/mol. Its IUPAC name is 2-(2-acetyl-4-chloro-5-methylanilino)acetamide.

Molecular Properties

Compound Name2-(2-acetyl-4-chloro-5-methylanilino)acetamide
PubChem CID141175373
Molecular FormulaC11H13ClN2O2
Molecular Weight240.69 g/mol
Exact Mass240.07
IUPAC Name2-(2-acetyl-4-chloro-5-methylanilino)acetamide
SMILESCC(=O)c1cc(Cl)c(C)cc1NCC(N)=O
InChIInChI=1S/C11H13ClN2O2/c1-6-3-10(14-5-11(13)16)8(7(2)15)4-9(6)12/h3-4,14H,5H2,1-2H3,(H2,13,16)
InChIKeyGTFWLMMIEYASCW-UHFFFAOYSA-N
XLogP1.75
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.69
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-4-chloro-5-methylanilino)acetamide?
The IUPAC name of 2-(2-acetyl-4-chloro-5-methylanilino)acetamide (CID 141175373) is 2-(2-acetyl-4-chloro-5-methylanilino)acetamide.
What is the SMILES notation for 2-(2-acetyl-4-chloro-5-methylanilino)acetamide?
The canonical SMILES for 2-(2-acetyl-4-chloro-5-methylanilino)acetamide is CC(=O)c1cc(Cl)c(C)cc1NCC(N)=O.
What is the InChIKey of 2-(2-acetyl-4-chloro-5-methylanilino)acetamide?
The InChIKey is GTFWLMMIEYASCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O2/c1-6-3-10(14-5-11(13)16)8(7(2)15)4-9(6)12/h3-4,14H,5H2,1-2H3,(H2,13,16).
What are the key properties of 2-(2-acetyl-4-chloro-5-methylanilino)acetamide?
2-(2-acetyl-4-chloro-5-methylanilino)acetamide has a molecular weight of 240.69 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-4-chloro-5-methylanilino)acetamide is sourced from PubChem (CID 141175373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).