[1-(3-methylphenyl)piperidin-4-yl]methanol

C13H19NO — CID 117027926

IUPAC[1-(3-methylphenyl)piperidin-4-yl]methanol
SMILESCc1cccc(N2CCC(CO)CC2)c1
InChIInChI=1S/C13H19NO/c1-11-3-2-4-13(9-11)14-7-5-12(10-15)6-8-14/h2-4,9,12,15H,5-8,10H2,1H3
InChIKeyJXXWGBRZMQFYCS-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.20
Rot. Bonds2

About [1-(3-methylphenyl)piperidin-4-yl]methanol

[1-(3-methylphenyl)piperidin-4-yl]methanol (PubChem CID 117027926) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is [1-(3-methylphenyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(3-methylphenyl)piperidin-4-yl]methanol
PubChem CID117027926
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name[1-(3-methylphenyl)piperidin-4-yl]methanol
SMILESCc1cccc(N2CCC(CO)CC2)c1
InChIInChI=1S/C13H19NO/c1-11-3-2-4-13(9-11)14-7-5-12(10-15)6-8-14/h2-4,9,12,15H,5-8,10H2,1H3
InChIKeyJXXWGBRZMQFYCS-UHFFFAOYSA-N
XLogP2.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(3-bromo-4-methylphenyl)piperidin-4-yl]methanol
CID 117027951
1-(3-methylphenyl)piperidine-4-carboxylic acid
CID 59023368
ethane;1-(3-methylphenyl)pyrrolidin-3-ol
CID 168922938
2-[1-(3-methylphenyl)piperidin-3-yl]ethanol
CID 117025976
[1-(4-methoxy-3-methylphenyl)piperidin-4-yl]methanol
CID 126696055
1-(3-methylphenyl)-N-propylpiperidin-4-amine
CID 43315485
4-[4-(hydroxymethyl)piperidin-1-yl]-2-methylbenzoic acid
CID 113400000
[1-(3-methyl-4-nitrophenyl)piperidin-4-yl]methanol
CID 47281098
1-(3-methylphenyl)piperidine;propane
CID 143942273
N-[[1-(3-methylphenyl)pyrrolidin-3-yl]methyl]propanamide
CID 110640432
1-(2-cyclohexylethyl)-4-(3-methylphenyl)piperazine
CID 173113720
3-methyl-N-[[1-(3-methylphenyl)pyrrolidin-3-yl]methyl]benzamide
CID 110640446

Frequently Asked Questions

What is the IUPAC name of [1-(3-methylphenyl)piperidin-4-yl]methanol?
The IUPAC name of [1-(3-methylphenyl)piperidin-4-yl]methanol (CID 117027926) is [1-(3-methylphenyl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(3-methylphenyl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(3-methylphenyl)piperidin-4-yl]methanol is Cc1cccc(N2CCC(CO)CC2)c1.
What is the InChIKey of [1-(3-methylphenyl)piperidin-4-yl]methanol?
The InChIKey is JXXWGBRZMQFYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-11-3-2-4-13(9-11)14-7-5-12(10-15)6-8-14/h2-4,9,12,15H,5-8,10H2,1H3.
What are the key properties of [1-(3-methylphenyl)piperidin-4-yl]methanol?
[1-(3-methylphenyl)piperidin-4-yl]methanol has a molecular weight of 205.30 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methylphenyl)piperidin-4-yl]methanol is sourced from PubChem (CID 117027926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).