2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide

C18H21ClN2O — CID 2649472

IUPAC2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
SMILESCCc1cccc(C)c1NC(=O)CNc1cc(Cl)ccc1C
InChIInChI=1S/C18H21ClN2O/c1-4-14-7-5-6-13(3)18(14)21-17(22)11-20-16-10-15(19)9-8-12(16)2/h5-10,20H,4,11H2,1-3H3,(H,21,22)
InChIKeyCPMUEYVYYBBPJF-UHFFFAOYSA-N
MW316.83 g/mol
LogP4.57
Rot. Bonds5

About 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide

2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide (PubChem CID 2649472) has the molecular formula C18H21ClN2O and a molecular weight of 316.83 g/mol. Its IUPAC name is 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
PubChem CID2649472
Molecular FormulaC18H21ClN2O
Molecular Weight316.83 g/mol
Exact Mass316.13
IUPAC Name2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
SMILESCCc1cccc(C)c1NC(=O)CNc1cc(Cl)ccc1C
InChIInChI=1S/C18H21ClN2O/c1-4-14-7-5-6-13(3)18(14)21-17(22)11-20-16-10-15(19)9-8-12(16)2/h5-10,20H,4,11H2,1-3H3,(H,21,22)
InChIKeyCPMUEYVYYBBPJF-UHFFFAOYSA-N
XLogP4.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.83
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dichloroanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 54815902
N-(2,4-dichlorophenyl)-N'-(2-ethyl-6-methylphenyl)propanediamide
CID 108954244
N-(5-chloro-2-cyanophenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 60537508
2-[2-chloro-5-(hydroxymethyl)anilino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 110929600
N-[3-[[2-(5-chloro-2-methylanilino)acetyl]amino]phenyl]propanamide
CID 54819153
N-(2,6-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004349
2-(4-bromo-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 9106775
2-(5-chloro-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 2541105
N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide
CID 108512069
N-(2,5-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004454
2-(5-chloro-2-methylanilino)-N-(2-chlorophenyl)acetamide
CID 9102932
2-(4-chloro-2-methyl-3-methylsulfonylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 22307577

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide?
The IUPAC name of 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide (CID 2649472) is 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide.
What is the SMILES notation for 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide?
The canonical SMILES for 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide is CCc1cccc(C)c1NC(=O)CNc1cc(Cl)ccc1C.
What is the InChIKey of 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide?
The InChIKey is CPMUEYVYYBBPJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O/c1-4-14-7-5-6-13(3)18(14)21-17(22)11-20-16-10-15(19)9-8-12(16)2/h5-10,20H,4,11H2,1-3H3,(H,21,22).
What are the key properties of 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide?
2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide has a molecular weight of 316.83 g/mol, XLogP of 4.57, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methylanilino)-N-(2-ethyl-6-methylphenyl)acetamide is sourced from PubChem (CID 2649472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).