2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone

C15H21NO2 — CID 82130939

IUPAC2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone
SMILESCc1ccc(C(O)C(=O)N2CCCCC2)c(C)c1
InChIInChI=1S/C15H21NO2/c1-11-6-7-13(12(2)10-11)14(17)15(18)16-8-4-3-5-9-16/h6-7,10,14,17H,3-5,8-9H2,1-2H3
InChIKeyOYHCTKQPZSSKFM-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.35
Rot. Bonds2

About 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone

2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone (PubChem CID 82130939) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone
PubChem CID82130939
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone
SMILESCc1ccc(C(O)C(=O)N2CCCCC2)c(C)c1
InChIInChI=1S/C15H21NO2/c1-11-6-7-13(12(2)10-11)14(17)15(18)16-8-4-3-5-9-16/h6-7,10,14,17H,3-5,8-9H2,1-2H3
InChIKeyOYHCTKQPZSSKFM-UHFFFAOYSA-N
XLogP2.35
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone 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

1-(azepan-1-yl)-2-chloro-2-(2,5-dimethylphenyl)ethanone
CID 62224830
2-(2,4-dimethylanilino)-1-piperidin-1-ylpropan-1-one
CID 43083827
(2R)-2-hydroxy-2-phenyl-1-piperidin-1-ylethanone
CID 25233871
2-(2,4-dimethylphenyl)-2-hydroxy-N,N-dimethylacetamide
CID 82126531
(2S)-2-hydroxy-2-phenyl-1-piperidin-1-ylethanone
CID 11257941
2-[2-[(1R)-1-aminoethyl]-5-methylphenoxy]-1-piperidin-1-ylpropan-1-one
CID 78947051
(2,4-dimethylphenyl)-pyrrolidin-1-ylmethanone
CID 925317
ethyl (2S)-2-(2,4-dimethylphenyl)-2-hydroxyacetate
CID 102392309
2-amino-1-pyrrolidin-1-yl-2-(2,4,5-trimethylphenyl)ethanone
CID 116851324
2-amino-1-(azepan-1-yl)-2-(4-methylphenyl)ethanone
CID 106151029
2-(2,4-dimethylphenyl)-1-pyrrolidin-1-ylethanone
CID 95970810
1-(2,5-dimethylphenyl)-1-piperidin-1-ylpropan-2-one
CID 116860030

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone?
The IUPAC name of 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone (CID 82130939) is 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone is Cc1ccc(C(O)C(=O)N2CCCCC2)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone?
The InChIKey is OYHCTKQPZSSKFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-11-6-7-13(12(2)10-11)14(17)15(18)16-8-4-3-5-9-16/h6-7,10,14,17H,3-5,8-9H2,1-2H3.
What are the key properties of 2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone?
2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone has a molecular weight of 247.34 g/mol, XLogP of 2.35, 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-1-piperidin-1-ylethanone is sourced from PubChem (CID 82130939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).