2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone

C11H16N2O — CID 117283238

IUPAC2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone
SMILESCc1ccc(N(C)C)c(C(=O)CN)c1
InChIInChI=1S/C11H16N2O/c1-8-4-5-10(13(2)3)9(6-8)11(14)7-12/h4-6H,7,12H2,1-3H3
InChIKeyRNYNPYUWCJLGHP-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.20
Rot. Bonds3

About 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone

2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone (PubChem CID 117283238) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone.

Molecular Properties

Compound Name2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone
PubChem CID117283238
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone
SMILESCc1ccc(N(C)C)c(C(=O)CN)c1
InChIInChI=1S/C11H16N2O/c1-8-4-5-10(13(2)3)9(6-8)11(14)7-12/h4-6H,7,12H2,1-3H3
InChIKeyRNYNPYUWCJLGHP-UHFFFAOYSA-N
XLogP1.20
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dimethylamino)-N,N,5-trimethylbenzamide
CID 118297012
2-amino-1-(2-chloro-5-methylphenyl)ethanone
CID 83696787
2-amino-1-(2-fluoro-4-methylphenyl)ethanone
CID 59233227
2-amino-1-(2,3,5-trimethylphenyl)ethanone
CID 117277600
2-amino-N-(2-bromo-4-methylphenyl)-N-methylacetamide
CID 28794580
2-[2-hydroxyethyl(methyl)amino]-5-methylbenzoic acid
CID 62514138
5-amino-2-(dimethylamino)-N-(2,5-dimethylphenyl)benzamide
CID 61089997
N'-hydroxy-5-methyl-2-[methyl(pentan-3-yl)amino]benzenecarboximidamide
CID 107929771
2-[2,2-dimethylpropyl(methyl)amino]-5-methylbenzoic acid
CID 62516741
2-amino-1-[5-(2-aminoacetyl)-2,4-dihydroxyphenyl]ethanone
CID 170860296
2-[(E)-3-aminoprop-1-enyl]-N,N,4-trimethylaniline
CID 117282062
2-ethyl-N,N,5-trimethylaniline
CID 59382459

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone?
The IUPAC name of 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone (CID 117283238) is 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone.
What is the SMILES notation for 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone?
The canonical SMILES for 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone is Cc1ccc(N(C)C)c(C(=O)CN)c1.
What is the InChIKey of 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone?
The InChIKey is RNYNPYUWCJLGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8-4-5-10(13(2)3)9(6-8)11(14)7-12/h4-6H,7,12H2,1-3H3.
What are the key properties of 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone?
2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone has a molecular weight of 192.26 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone is sourced from PubChem (CID 117283238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).