2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol

C15H23NO — CID 82290403

IUPAC2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol
SMILESCc1cc(CCO)ccc1N1CCC(C)CC1
InChIInChI=1S/C15H23NO/c1-12-5-8-16(9-6-12)15-4-3-14(7-10-17)11-13(15)2/h3-4,11-12,17H,5-10H2,1-2H3
InChIKeyBOJCXZRHXZBIDA-UHFFFAOYSA-N
MW233.35 g/mol
LogP2.77
Rot. Bonds3

About 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol

2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol (PubChem CID 82290403) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol
PubChem CID82290403
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol
SMILESCc1cc(CCO)ccc1N1CCC(C)CC1
InChIInChI=1S/C15H23NO/c1-12-5-8-16(9-6-12)15-4-3-14(7-10-17)11-13(15)2/h3-4,11-12,17H,5-10H2,1-2H3
InChIKeyBOJCXZRHXZBIDA-UHFFFAOYSA-N
XLogP2.77
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[3-methyl-4-(4-methylazepan-1-yl)phenyl]methanamine
CID 63624111
[3-methyl-4-(4-propan-2-ylpiperidin-1-yl)phenyl]methanol
CID 103498515
[3-chloro-4-(4-methylpiperidin-1-yl)phenyl]methanol
CID 81152536
2-methoxy-N-[[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]methyl]ethanamine
CID 63058712
2-[4-(4-ethylpiperidin-1-yl)-3-methylphenyl]ethanamine
CID 63786885
[4-(4-cyclopropylpiperazin-1-yl)-3-methylphenyl]methanol
CID 55039974
1-[4-(hydroxymethyl)-2-methylphenyl]pyrrolidin-3-ol
CID 62941166
[3-methyl-4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]methanol
CID 62122049
N-[[1-[4-(hydroxymethyl)-2-methylphenyl]piperidin-4-yl]methyl]acetamide
CID 102736595
2-[4-[4-(cyclopropylmethyl)piperazin-1-yl]-3-methylphenyl]ethanamine
CID 63785404
4-methyl-1-[2-methyl-4-(methylaminomethyl)phenyl]piperidin-3-ol
CID 102960910
[3-methyl-4-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)phenyl]methanol
CID 79174316

Frequently Asked Questions

What is the IUPAC name of 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol?
The IUPAC name of 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol (CID 82290403) is 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol.
What is the SMILES notation for 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol?
The canonical SMILES for 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol is Cc1cc(CCO)ccc1N1CCC(C)CC1.
What is the InChIKey of 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol?
The InChIKey is BOJCXZRHXZBIDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-5-8-16(9-6-12)15-4-3-14(7-10-17)11-13(15)2/h3-4,11-12,17H,5-10H2,1-2H3.
What are the key properties of 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol?
2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol has a molecular weight of 233.35 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-methyl-4-(4-methylpiperidin-1-yl)phenyl]ethanol is sourced from PubChem (CID 82290403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).