1-(3-methylphenyl)piperidin-4-ol

C12H17NO — CID 82075640

IUPAC1-(3-methylphenyl)piperidin-4-ol
SMILESCc1cccc(N2CCC(O)CC2)c1
InChIInChI=1S/C12H17NO/c1-10-3-2-4-11(9-10)13-7-5-12(14)6-8-13/h2-4,9,12,14H,5-8H2,1H3
InChIKeyDIWADYROGRQDDC-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.96
Rot. Bonds1

About 1-(3-methylphenyl)piperidin-4-ol

1-(3-methylphenyl)piperidin-4-ol (PubChem CID 82075640) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 1-(3-methylphenyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(3-methylphenyl)piperidin-4-ol
PubChem CID82075640
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name1-(3-methylphenyl)piperidin-4-ol
SMILESCc1cccc(N2CCC(O)CC2)c1
InChIInChI=1S/C12H17NO/c1-10-3-2-4-11(9-10)13-7-5-12(14)6-8-13/h2-4,9,12,14H,5-8H2,1H3
InChIKeyDIWADYROGRQDDC-UHFFFAOYSA-N
XLogP1.96
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)piperidin-4-ol?
The IUPAC name of 1-(3-methylphenyl)piperidin-4-ol (CID 82075640) is 1-(3-methylphenyl)piperidin-4-ol.
What is the SMILES notation for 1-(3-methylphenyl)piperidin-4-ol?
The canonical SMILES for 1-(3-methylphenyl)piperidin-4-ol is Cc1cccc(N2CCC(O)CC2)c1.
What is the InChIKey of 1-(3-methylphenyl)piperidin-4-ol?
The InChIKey is DIWADYROGRQDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-10-3-2-4-11(9-10)13-7-5-12(14)6-8-13/h2-4,9,12,14H,5-8H2,1H3.
What are the key properties of 1-(3-methylphenyl)piperidin-4-ol?
1-(3-methylphenyl)piperidin-4-ol has a molecular weight of 191.27 g/mol, XLogP of 1.96, 1 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-ol is sourced from PubChem (CID 82075640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).