1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol

C15H23NO — CID 82290252

IUPAC1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol
SMILESCc1ccc(C(C)(O)C2CCNCC2)cc1C
InChIInChI=1S/C15H23NO/c1-11-4-5-14(10-12(11)2)15(3,17)13-6-8-16-9-7-13/h4-5,10,13,16-17H,6-9H2,1-3H3
InChIKeyJRVVANULYMFZLW-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.51
Rot. Bonds2

About 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol

1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol (PubChem CID 82290252) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol.

Molecular Properties

Compound Name1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol
PubChem CID82290252
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol
SMILESCc1ccc(C(C)(O)C2CCNCC2)cc1C
InChIInChI=1S/C15H23NO/c1-11-4-5-14(10-12(11)2)15(3,17)13-6-8-16-9-7-13/h4-5,10,13,16-17H,6-9H2,1-3H3
InChIKeyJRVVANULYMFZLW-UHFFFAOYSA-N
XLogP2.51
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol 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-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol
CID 64748987
1-phenyl-1-piperidin-4-ylethanol
CID 54545036
1-(3-aminophenyl)-1-piperidin-4-ylethanol
CID 115032215
(1S)-1-cyclopropyl-1-(3-fluoro-4-methylphenyl)ethanol
CID 97051318
1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol
CID 82302421
(1R)-1-cyclopropyl-1-(3-fluoro-4-methylphenyl)ethanol
CID 97051317
1-(2,3-dimethylphenyl)-1-piperidin-4-ylethanol
CID 82290402
(1S)-1-cyclopropyl-1-(3-methylphenyl)ethanol
CID 93311992
3-(1-hydroxy-1-pyrrolidin-3-ylethyl)benzoic acid
CID 115040778
4-[2-(3,4-dimethylphenyl)-2,2-difluoroethyl]piperidine
CID 116840354
1-(3-tert-butylphenyl)-1-cyclopropylethanol
CID 91657928
1-(2,4-dimethoxyphenyl)-1-piperidin-4-ylethanol
CID 82304157

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol?
The IUPAC name of 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol (CID 82290252) is 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol.
What is the SMILES notation for 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol?
The canonical SMILES for 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol is Cc1ccc(C(C)(O)C2CCNCC2)cc1C.
What is the InChIKey of 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol?
The InChIKey is JRVVANULYMFZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-4-5-14(10-12(11)2)15(3,17)13-6-8-16-9-7-13/h4-5,10,13,16-17H,6-9H2,1-3H3.
What are the key properties of 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol?
1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol has a molecular weight of 233.36 g/mol, XLogP of 2.51, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylphenyl)-1-piperidin-4-ylethanol is sourced from PubChem (CID 82290252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).