2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol

C15H24N2O2 — CID 111543946

IUPAC2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol
SMILESCC(C)(O)CN1CCC(COc2ccccn2)CC1
InChIInChI=1S/C15H24N2O2/c1-15(2,18)12-17-9-6-13(7-10-17)11-19-14-5-3-4-8-16-14/h3-5,8,13,18H,6-7,9-12H2,1-2H3
InChIKeyPLGSTUNDVXEFNM-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.94
Rot. Bonds5

About 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol

2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol (PubChem CID 111543946) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol
PubChem CID111543946
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol
SMILESCC(C)(O)CN1CCC(COc2ccccn2)CC1
InChIInChI=1S/C15H24N2O2/c1-15(2,18)12-17-9-6-13(7-10-17)11-19-14-5-3-4-8-16-14/h3-5,8,13,18H,6-7,9-12H2,1-2H3
InChIKeyPLGSTUNDVXEFNM-UHFFFAOYSA-N
XLogP1.94
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol?
The IUPAC name of 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol (CID 111543946) is 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol.
What is the SMILES notation for 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol?
The canonical SMILES for 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol is CC(C)(O)CN1CCC(COc2ccccn2)CC1.
What is the InChIKey of 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol?
The InChIKey is PLGSTUNDVXEFNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-15(2,18)12-17-9-6-13(7-10-17)11-19-14-5-3-4-8-16-14/h3-5,8,13,18H,6-7,9-12H2,1-2H3.
What are the key properties of 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol?
2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol has a molecular weight of 264.37 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 111543946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).