2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide

C12H17NO2 — CID 82126531

IUPAC2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide
SMILESCc1ccc(C(O)C(=O)N(C)C)c(C)c1
InChIInChI=1S/C12H17NO2/c1-8-5-6-10(9(2)7-8)11(14)12(15)13(3)4/h5-7,11,14H,1-4H3
InChIKeyTVSJRPFOMGTGFB-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.43
Rot. Bonds2

About 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide

2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide (PubChem CID 82126531) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide
PubChem CID82126531
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide
SMILESCc1ccc(C(O)C(=O)N(C)C)c(C)c1
InChIInChI=1S/C12H17NO2/c1-8-5-6-10(9(2)7-8)11(14)12(15)13(3)4/h5-7,11,14H,1-4H3
InChIKeyTVSJRPFOMGTGFB-UHFFFAOYSA-N
XLogP1.43
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide 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

ethyl (2S)-2-(2,4-dimethylphenyl)-2-hydroxyacetate
CID 102392309
2-amino-2-(2,4-dimethylphenyl)-N-methylacetohydrazide
CID 116848899
2-(2,4-dimethylphenyl)-2-hydroxy-N-phenylacetamide
CID 82132089
2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone
CID 82130939
3-[[2-(2,4-dimethylphenyl)-2-hydroxyethyl]-methylamino]propanoic acid
CID 82216029
(4-bromo-2-methylphenyl)-(2,4-dimethylphenyl)methanol
CID 61101101
S-(2,4-dimethylphenyl) N,N-dimethylcarbamothioate
CID 23250907
(2,4-dimethylphenyl)-phenylmethanol
CID 3807153
(2,4-dimethylphenyl)-(2,3,5,6-tetramethylphenyl)methanol
CID 63426281
1-(2,4-dimethylphenyl)-2,2-dimethylpropan-1-ol
CID 15732089
ethyl 3-(2,4-dimethylphenyl)-2,3-dihydroxypropanoate
CID 171865672
1-(2,4-dimethylphenyl)-1-(methylamino)propan-2-one
CID 116955821

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide?
The IUPAC name of 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide (CID 82126531) is 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide?
The canonical SMILES for 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide is Cc1ccc(C(O)C(=O)N(C)C)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide?
The InChIKey is TVSJRPFOMGTGFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-8-5-6-10(9(2)7-8)11(14)12(15)13(3)4/h5-7,11,14H,1-4H3.
What are the key properties of 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide?
2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide has a molecular weight of 207.27 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide is sourced from PubChem (CID 82126531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).