2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride

C13H21ClN2O — CID 119674500

IUPAC2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride
SMILESCNCC(=O)Nc1c(C)cccc1C(C)C.Cl
InChIInChI=1S/C13H20N2O.ClH/c1-9(2)11-7-5-6-10(3)13(11)15-12(16)8-14-4;/h5-7,9,14H,8H2,1-4H3,(H,15,16);1H
InChIKeyWRQPTUUFERJNCP-UHFFFAOYSA-N
MW256.78 g/mol
LogP2.70
Rot. Bonds4

About 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride

2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride (PubChem CID 119674500) has the molecular formula C13H21ClN2O and a molecular weight of 256.78 g/mol. Its IUPAC name is 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride
PubChem CID119674500
Molecular FormulaC13H21ClN2O
Molecular Weight256.78 g/mol
Exact Mass256.13
IUPAC Name2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride
SMILESCNCC(=O)Nc1c(C)cccc1C(C)C.Cl
InChIInChI=1S/C13H20N2O.ClH/c1-9(2)11-7-5-6-10(3)13(11)15-12(16)8-14-4;/h5-7,9,14H,8H2,1-4H3,(H,15,16);1H
InChIKeyWRQPTUUFERJNCP-UHFFFAOYSA-N
XLogP2.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.78
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride 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

N-(2-methyl-6-propan-2-ylphenyl)-2-sulfanylacetamide
CID 715390
4-hydroxy-N-(2-methyl-6-propan-2-ylphenyl)butanamide
CID 79019177
N-(2-methyl-6-propan-2-ylphenyl)-2-(propylamino)acetamide
CID 60648439
4-(2-methyl-6-propan-2-ylanilino)-4-oxobutanoic acid
CID 9154947
3-amino-N-(2-methyl-6-propan-2-ylphenyl)-3-sulfanylidenepropanamide
CID 28942450
N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 729062
2-cyano-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 3634082
2-[ethyl(methyl)amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 60516691
N-(2-methyl-6-propan-2-ylphenyl)-3-methylsulfanylpropanamide
CID 112789085
2-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 2112763
N',N'-diethyl-N-(2-methyl-6-propan-2-ylphenyl)propanediamide
CID 108951086
2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 2165744

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride?
The IUPAC name of 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride (CID 119674500) is 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride?
The canonical SMILES for 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride is CNCC(=O)Nc1c(C)cccc1C(C)C.Cl.
What is the InChIKey of 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride?
The InChIKey is WRQPTUUFERJNCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O.ClH/c1-9(2)11-7-5-6-10(3)13(11)15-12(16)8-14-4;/h5-7,9,14H,8H2,1-4H3,(H,15,16);1H.
What are the key properties of 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride?
2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride has a molecular weight of 256.78 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride is sourced from PubChem (CID 119674500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).