N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride

C12H19ClN2O — CID 119741824

IUPACN-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)N(C)c1ccc(C)c(C)c1.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-9-5-6-11(7-10(9)2)14(4)12(15)8-13-3;/h5-7,13H,8H2,1-4H3;1H
InChIKeyKCYNDKVNDSKNMJ-UHFFFAOYSA-N
MW242.75 g/mol
LogP1.91
Rot. Bonds3

About N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride

N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride (PubChem CID 119741824) has the molecular formula C12H19ClN2O and a molecular weight of 242.75 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride
PubChem CID119741824
Molecular FormulaC12H19ClN2O
Molecular Weight242.75 g/mol
Exact Mass242.12
IUPAC NameN-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)N(C)c1ccc(C)c(C)c1.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-9-5-6-11(7-10(9)2)14(4)12(15)8-13-3;/h5-7,13H,8H2,1-4H3;1H
InChIKeyKCYNDKVNDSKNMJ-UHFFFAOYSA-N
XLogP1.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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ethyl 3-oxo-3-(N,3,4-trimethylanilino)propanoate
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N-(4-hydroxyphenyl)-N-methyl-2-(methylamino)acetamide
CID 103606278
N-(3,4-dimethylphenyl)-N,3-dimethylbutanamide
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4-[methyl-[2-(methylamino)acetyl]amino]benzoic acid
CID 18618377
N-(3,4-dimethylphenyl)-N-methyl-2-(methylaminomethyl)butanamide
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N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-N-methyl-2-(methylamino)acetamide
CID 82501060
N-(4-ethoxyphenyl)-N-methyl-2-(methylamino)acetamide
CID 96672511
2-cyclopentyl-N-(3,4-dimethylphenyl)-N-methylacetamide
CID 123790162
N-(3,4-dimethylphenyl)-2-[dimethylsulfamoyl(methyl)amino]-N-methylacetamide
CID 100784998
methyl 2-oxo-2-(N,3,4-trimethylanilino)acetate
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N-(3,4-dihydro-2H-chromen-6-yl)-N-methyl-2-(methylamino)acetamide
CID 82496343

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride (CID 119741824) is N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride is CNCC(=O)N(C)c1ccc(C)c(C)c1.Cl.
What is the InChIKey of N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride?
The InChIKey is KCYNDKVNDSKNMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O.ClH/c1-9-5-6-11(7-10(9)2)14(4)12(15)8-13-3;/h5-7,13H,8H2,1-4H3;1H.
What are the key properties of N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride?
N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride has a molecular weight of 242.75 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-N-methyl-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 119741824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).