2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide

C13H19ClN2O2 — CID 51726773

IUPAC2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide
SMILESCOC[C@@H](C)NC(=O)CNc1ccc(Cl)cc1C
InChIInChI=1S/C13H19ClN2O2/c1-9-6-11(14)4-5-12(9)15-7-13(17)16-10(2)8-18-3/h4-6,10,15H,7-8H2,1-3H3,(H,16,17)/t10-/m1/s1
InChIKeyTZJWECBCYXYNGB-SNVBAGLBSA-N
MW270.76 g/mol
LogP2.21
Rot. Bonds6

About 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide

2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide (PubChem CID 51726773) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide.

Molecular Properties

Compound Name2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide
PubChem CID51726773
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC Name2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide
SMILESCOC[C@@H](C)NC(=O)CNc1ccc(Cl)cc1C
InChIInChI=1S/C13H19ClN2O2/c1-9-6-11(14)4-5-12(9)15-7-13(17)16-10(2)8-18-3/h4-6,10,15H,7-8H2,1-3H3,(H,16,17)/t10-/m1/s1
InChIKeyTZJWECBCYXYNGB-SNVBAGLBSA-N
XLogP2.21
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-chloro-3-methylanilino)-N-(1-methoxypropan-2-yl)acetamide
CID 113246770
2-(2-chloro-4-fluoroanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 51728732
2-(5-bromo-4-fluoro-2-methylanilino)-N-(1-methoxypropan-2-yl)acetamide
CID 103238726
2-(4-chloro-2-methoxy-5-methylanilino)-N-(1-methoxypropan-2-yl)acetamide
CID 47123139
2-(4-chloro-2-methylanilino)-N-(2-methoxyethylcarbamoyl)acetamide
CID 26507186
2-(4-bromo-2-fluoroanilino)-N-(1-methoxypropan-2-yl)acetamide
CID 51252744
2-(5-bromo-2-fluoroanilino)-N-(1-methoxypropan-2-yl)acetamide
CID 54957373
2-(4-chloro-2-methylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 109007918
4-chloro-N-(3-methoxy-2-methylpropyl)-2-methylaniline
CID 116500771
2-(4-chloro-2-methylanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 26507073
2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide
CID 26507119
2-(2-bromo-4-fluoroanilino)-N-(1-methoxypropan-2-yl)acetamide
CID 54957320

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide?
The IUPAC name of 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide (CID 51726773) is 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide.
What is the SMILES notation for 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide?
The canonical SMILES for 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide is COC[C@@H](C)NC(=O)CNc1ccc(Cl)cc1C.
What is the InChIKey of 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide?
The InChIKey is TZJWECBCYXYNGB-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c1-9-6-11(14)4-5-12(9)15-7-13(17)16-10(2)8-18-3/h4-6,10,15H,7-8H2,1-3H3,(H,16,17)/t10-/m1/s1.
What are the key properties of 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide?
2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide has a molecular weight of 270.76 g/mol, XLogP of 2.21, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylanilino)-N-[(2R)-1-methoxypropan-2-yl]acetamide is sourced from PubChem (CID 51726773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).