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

C15H23NO — CID 82165998

IUPAC1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol
SMILESCC(O)c1ccc(CN2CCCCC2C)cc1
InChIInChI=1S/C15H23NO/c1-12-5-3-4-10-16(12)11-14-6-8-15(9-7-14)13(2)17/h6-9,12-13,17H,3-5,10-11H2,1-2H3
InChIKeyCVRYQESYQLOPHR-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.11
Rot. Bonds3

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

1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol (PubChem CID 82165998) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol.

Molecular Properties

Compound Name1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol
PubChem CID82165998
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol
SMILESCC(O)c1ccc(CN2CCCCC2C)cc1
InChIInChI=1S/C15H23NO/c1-12-5-3-4-10-16(12)11-14-6-8-15(9-7-14)13(2)17/h6-9,12-13,17H,3-5,10-11H2,1-2H3
InChIKeyCVRYQESYQLOPHR-UHFFFAOYSA-N
XLogP3.11
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(4-iodophenyl)methyl]-2-methylpiperidine
CID 65477935
4-[[(2R)-2-methylpiperidin-1-yl]methyl]benzenethiol
CID 97294059
N-ethyl-2-[4-[(2-methylazepan-1-yl)methyl]phenyl]propan-1-amine
CID 105347840
2-methyl-N-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]propanamide
CID 47288928
2-methyl-N-[[4-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]propanamide
CID 86990672
2-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]acetonitrile
CID 82135679
1-(furan-3-ylmethyl)-2-methylpiperidine
CID 131067183
3-amino-2-methyl-N-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]-3-phenylpropanamide
CID 119844935
2-(chloromethyl)-1-[(4-propan-2-ylphenyl)methyl]piperidine
CID 55182780
[2-fluoro-5-[(2-methylpiperidin-1-yl)methyl]phenyl]boronic acid
CID 54970904
(2S)-2-amino-3,3-dimethyl-N-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]butanamide
CID 119844945
1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol
CID 111106746

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol?
The IUPAC name of 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol (CID 82165998) is 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol.
What is the SMILES notation for 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol?
The canonical SMILES for 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol is CC(O)c1ccc(CN2CCCCC2C)cc1.
What is the InChIKey of 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol?
The InChIKey is CVRYQESYQLOPHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-5-3-4-10-16(12)11-14-6-8-15(9-7-14)13(2)17/h6-9,12-13,17H,3-5,10-11H2,1-2H3.
What are the key properties of 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol?
1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol has a molecular weight of 233.36 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]ethanol is sourced from PubChem (CID 82165998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).