1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol

C17H27NO — CID 82302421

IUPAC1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol
SMILESCc1cc(C)c(C)c(C(C)(O)C2CCNCC2)c1C
InChIInChI=1S/C17H27NO/c1-11-10-12(2)14(4)16(13(11)3)17(5,19)15-6-8-18-9-7-15/h10,15,18-19H,6-9H2,1-5H3
InChIKeyOSKQZNXBISWZEM-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.13
Rot. Bonds2

About 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol

1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol (PubChem CID 82302421) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol.

Molecular Properties

Compound Name1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol
PubChem CID82302421
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol
SMILESCc1cc(C)c(C)c(C(C)(O)C2CCNCC2)c1C
InChIInChI=1S/C17H27NO/c1-11-10-12(2)14(4)16(13(11)3)17(5,19)15-6-8-18-9-7-15/h10,15,18-19H,6-9H2,1-5H3
InChIKeyOSKQZNXBISWZEM-UHFFFAOYSA-N
XLogP3.13
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol 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-piperidin-4-ylethanol
CID 82290252
1-(2,3-dimethylphenyl)-1-piperidin-4-ylethanol
CID 82290402
1-phenyl-1-piperidin-4-ylethanol
CID 54545036
1-(3-aminophenyl)-1-piperidin-4-ylethanol
CID 115032215
1-(2-methylphenyl)-1-pyrrolidin-3-ylethanol
CID 105457980
1-(5-bromo-2-methoxyphenyl)-1-piperidin-4-ylethanol
CID 82309039
2,3-dimethyl-5-piperidin-4-ylphenol
CID 117293924
4-[difluoro-(2,4,6-trimethylphenyl)methyl]piperidine
CID 116838804
1-cyclopropyl-1-(2-fluoro-4,6-dimethylphenyl)ethanol
CID 106880260
1-(2,4-dimethoxyphenyl)-1-piperidin-4-ylethanol
CID 82304157
1-piperidin-4-yl-N-[(2,3,5,6-tetramethylphenyl)methyl]methanamine
CID 115209940
1-(2,5-dimethylphenyl)-1-piperidin-3-ylethanol
CID 63586450

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol?
The IUPAC name of 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol (CID 82302421) is 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol.
What is the SMILES notation for 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol?
The canonical SMILES for 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol is Cc1cc(C)c(C)c(C(C)(O)C2CCNCC2)c1C.
What is the InChIKey of 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol?
The InChIKey is OSKQZNXBISWZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-11-10-12(2)14(4)16(13(11)3)17(5,19)15-6-8-18-9-7-15/h10,15,18-19H,6-9H2,1-5H3.
What are the key properties of 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol?
1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol has a molecular weight of 261.41 g/mol, XLogP of 3.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-yl-1-(2,3,5,6-tetramethylphenyl)ethanol is sourced from PubChem (CID 82302421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).