2-acetamido-N-(2-chloro-4-methylphenyl)acetamide

C11H13ClN2O2 — CID 47101426

IUPAC2-acetamido-N-(2-chloro-4-methylphenyl)acetamide
SMILESCC(=O)NCC(=O)Nc1ccc(C)cc1Cl
InChIInChI=1S/C11H13ClN2O2/c1-7-3-4-10(9(12)5-7)14-11(16)6-13-8(2)15/h3-5H,6H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyCEKRGQFSUUGJRL-UHFFFAOYSA-N
MW240.69 g/mol
LogP1.72
Rot. Bonds3

About 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide

2-acetamido-N-(2-chloro-4-methylphenyl)acetamide (PubChem CID 47101426) has the molecular formula C11H13ClN2O2 and a molecular weight of 240.69 g/mol. Its IUPAC name is 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-acetamido-N-(2-chloro-4-methylphenyl)acetamide
PubChem CID47101426
Molecular FormulaC11H13ClN2O2
Molecular Weight240.69 g/mol
Exact Mass240.07
IUPAC Name2-acetamido-N-(2-chloro-4-methylphenyl)acetamide
SMILESCC(=O)NCC(=O)Nc1ccc(C)cc1Cl
InChIInChI=1S/C11H13ClN2O2/c1-7-3-4-10(9(12)5-7)14-11(16)6-13-8(2)15/h3-5H,6H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyCEKRGQFSUUGJRL-UHFFFAOYSA-N
XLogP1.72
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.69
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[2-(2-chloro-4-methylanilino)-2-oxoethyl]acetamide
CID 54928059
2-bromo-N-(2-chloro-4-methylphenyl)acetamide
CID 63678891
N-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-2-hydroxycyclopentane-1-carboxamide
CID 110015508
N-(2-chloro-4-methylphenyl)-2-(2,5-dimethylanilino)acetamide
CID 9079630
N-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-2,6-difluorobenzamide
CID 86865949
3-amino-N-(2-chloro-4-methylphenyl)-3-sulfanylidenepropanamide
CID 28967971
2-[[2-(2-chloro-4-methylanilino)-2-oxoethyl]amino]-2-methylpropanoic acid
CID 65263865
5-chloro-N-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-2-iodobenzamide
CID 60602258
1-amino-N-[2-(2-chloro-4-methylanilino)-2-oxoethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119309067
1-(2-chloro-4-methylphenyl)-3-ethylurea
CID 21161481
2-(azocan-1-ium-1-yl)-N-(2-chloro-4-methylphenyl)acetamide
CID 8583722
N-[(2-chloro-4-methylphenyl)methyl]acetamide
CID 91098777

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide?
The IUPAC name of 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide (CID 47101426) is 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide.
What is the SMILES notation for 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide?
The canonical SMILES for 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide is CC(=O)NCC(=O)Nc1ccc(C)cc1Cl.
What is the InChIKey of 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide?
The InChIKey is CEKRGQFSUUGJRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O2/c1-7-3-4-10(9(12)5-7)14-11(16)6-13-8(2)15/h3-5H,6H2,1-2H3,(H,13,15)(H,14,16).
What are the key properties of 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide?
2-acetamido-N-(2-chloro-4-methylphenyl)acetamide has a molecular weight of 240.69 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(2-chloro-4-methylphenyl)acetamide is sourced from PubChem (CID 47101426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).