2-(4-methoxyphenyl)-2-methylpiperidin-3-ol

C13H19NO2 — CID 115032686

IUPAC2-(4-methoxyphenyl)-2-methylpiperidin-3-ol
SMILESCOc1ccc(C2(C)NCCCC2O)cc1
InChIInChI=1S/C13H19NO2/c1-13(12(15)4-3-9-14-13)10-5-7-11(16-2)8-6-10/h5-8,12,14-15H,3-4,9H2,1-2H3
InChIKeyJUTCTTVVUIFZLA-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.65
Rot. Bonds2

About 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol

2-(4-methoxyphenyl)-2-methylpiperidin-3-ol (PubChem CID 115032686) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2-methylpiperidin-3-ol
PubChem CID115032686
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-(4-methoxyphenyl)-2-methylpiperidin-3-ol
SMILESCOc1ccc(C2(C)NCCCC2O)cc1
InChIInChI=1S/C13H19NO2/c1-13(12(15)4-3-9-14-13)10-5-7-11(16-2)8-6-10/h5-8,12,14-15H,3-4,9H2,1-2H3
InChIKeyJUTCTTVVUIFZLA-UHFFFAOYSA-N
XLogP1.65
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol?
The IUPAC name of 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol (CID 115032686) is 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol.
What is the SMILES notation for 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol?
The canonical SMILES for 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol is COc1ccc(C2(C)NCCCC2O)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol?
The InChIKey is JUTCTTVVUIFZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-13(12(15)4-3-9-14-13)10-5-7-11(16-2)8-6-10/h5-8,12,14-15H,3-4,9H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol?
2-(4-methoxyphenyl)-2-methylpiperidin-3-ol has a molecular weight of 221.30 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2-methylpiperidin-3-ol is sourced from PubChem (CID 115032686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).