[4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol

C15H23NO — CID 112631290

IUPAC[4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol
SMILESCC1CCCN(Cc2ccc(CO)cc2)C1C
InChIInChI=1S/C15H23NO/c1-12-4-3-9-16(13(12)2)10-14-5-7-15(11-17)8-6-14/h5-8,12-13,17H,3-4,9-11H2,1-2H3
InChIKeyHTDFNOBLRJIBEN-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.80
Rot. Bonds3

About [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol

[4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol (PubChem CID 112631290) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol
PubChem CID112631290
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name[4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol
SMILESCC1CCCN(Cc2ccc(CO)cc2)C1C
InChIInChI=1S/C15H23NO/c1-12-4-3-9-16(13(12)2)10-14-5-7-15(11-17)8-6-14/h5-8,12-13,17H,3-4,9-11H2,1-2H3
InChIKeyHTDFNOBLRJIBEN-UHFFFAOYSA-N
XLogP2.80
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 ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-[[4-(hydroxymethyl)phenyl]methyl]pyrrolidin-2-yl]propan-2-ol
CID 110009559
[4-[(2-ethylpiperidin-1-yl)methyl]phenyl]methanol
CID 83794056
5-[(2,3-dimethylpiperidin-1-yl)methyl]-N-ethylpyridin-2-amine
CID 62183133
[4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol
CID 110008065
1-[(5-bromofuran-3-yl)methyl]-2,3-dimethylpiperidine
CID 131020830
3,6-dichloro-2-[(2,3-dimethylpiperidin-1-yl)methyl]pyridine
CID 62891492
(2R,3R)-2-methyl-1-[(4-methylphenyl)methyl]piperidine-3-carboxylic acid
CID 122124688
[4-[[2-(2-cyclopropylphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol
CID 150173425
5-[(2,3-dimethylpiperidin-1-yl)methyl]-N'-hydroxy-2-methoxybenzenecarboximidamide
CID 77065866
3-[2-[(2,3-dimethylpiperidin-1-yl)methyl]-5-fluorophenyl]prop-2-yn-1-ol
CID 62124665
(2R,3R)-1-[(4-tert-butylphenyl)methyl]-2-methylpiperidine-3-carboxylic acid
CID 122124631
(2R,3R)-1-[(4-cyclopropylphenyl)methyl]-2-methylpiperidine-3-carboxylic acid
CID 122125097

Frequently Asked Questions

What is the IUPAC name of [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol?
The IUPAC name of [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol (CID 112631290) is [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol.
What is the SMILES notation for [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol?
The canonical SMILES for [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol is CC1CCCN(Cc2ccc(CO)cc2)C1C.
What is the InChIKey of [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol?
The InChIKey is HTDFNOBLRJIBEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-4-3-9-16(13(12)2)10-14-5-7-15(11-17)8-6-14/h5-8,12-13,17H,3-4,9-11H2,1-2H3.
What are the key properties of [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol?
[4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol has a molecular weight of 233.36 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol is sourced from PubChem (CID 112631290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).