N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide

C11H15ClN2O — CID 83537406

IUPACN-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide
SMILESCNCC(=O)Nc1c(C)cc(C)cc1Cl
InChIInChI=1S/C11H15ClN2O/c1-7-4-8(2)11(9(12)5-7)14-10(15)6-13-3/h4-5,13H,6H2,1-3H3,(H,14,15)
InChIKeyQAXJQGQYKYEOBZ-UHFFFAOYSA-N
MW226.71 g/mol
LogP2.11
Rot. Bonds3

About N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide

N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide (PubChem CID 83537406) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide
PubChem CID83537406
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC NameN-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide
SMILESCNCC(=O)Nc1c(C)cc(C)cc1Cl
InChIInChI=1S/C11H15ClN2O/c1-7-4-8(2)11(9(12)5-7)14-10(15)6-13-3/h4-5,13H,6H2,1-3H3,(H,14,15)
InChIKeyQAXJQGQYKYEOBZ-UHFFFAOYSA-N
XLogP2.11
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-(2-chloro-4,6-dimethylphenyl)acetamide
CID 2110931
2-bromo-N-(2-chloro-4,6-dimethylphenyl)acetamide
CID 81223490
N-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]butanamide
CID 112998242
3-[[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]amino]propanoic acid
CID 43466438
N-(2-chloro-4,6-dimethylphenyl)-5-hydroxypentanamide
CID 79018968
N-(2-chloro-4,6-dimethylphenyl)-2-(2,6-difluoroanilino)acetamide
CID 109008818
2-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]sulfanylacetic acid
CID 43237551
N-(2-chloro-4,6-dimethylphenyl)-2-[(4-chlorophenyl)methylamino]acetamide
CID 108998149
N-(2-chloro-4,6-dimethylphenyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19178203
N-(4-bromophenyl)-N'-(2-chloro-4,6-dimethylphenyl)propanediamide
CID 108955337
4-bromo-N-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]benzamide
CID 112998260
N-(2-chloro-4,6-dimethylphenyl)-2-[3-(dimethylamino)propylamino]acetamide
CID 108995128

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide?
The IUPAC name of N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide (CID 83537406) is N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide.
What is the SMILES notation for N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide?
The canonical SMILES for N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide is CNCC(=O)Nc1c(C)cc(C)cc1Cl.
What is the InChIKey of N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide?
The InChIKey is QAXJQGQYKYEOBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c1-7-4-8(2)11(9(12)5-7)14-10(15)6-13-3/h4-5,13H,6H2,1-3H3,(H,14,15).
What are the key properties of N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide?
N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide has a molecular weight of 226.71 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide is sourced from PubChem (CID 83537406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).