3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol

C13H26N2O — CID 114502746

IUPAC3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol
SMILESCC1CN(CCN2CCCCC2)CCC1O
InChIInChI=1S/C13H26N2O/c1-12-11-15(8-5-13(12)16)10-9-14-6-3-2-4-7-14/h12-13,16H,2-11H2,1H3
InChIKeyRYLIZEQQSOUAFY-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.17
Rot. Bonds3

About 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol

3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol (PubChem CID 114502746) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol.

Molecular Properties

Compound Name3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol
PubChem CID114502746
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol
SMILESCC1CN(CCN2CCCCC2)CCC1O
InChIInChI=1S/C13H26N2O/c1-12-11-15(8-5-13(12)16)10-9-14-6-3-2-4-7-14/h12-13,16H,2-11H2,1H3
InChIKeyRYLIZEQQSOUAFY-UHFFFAOYSA-N
XLogP1.17
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol?
The IUPAC name of 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol (CID 114502746) is 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol.
What is the SMILES notation for 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol?
The canonical SMILES for 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol is CC1CN(CCN2CCCCC2)CCC1O.
What is the InChIKey of 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol?
The InChIKey is RYLIZEQQSOUAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-12-11-15(8-5-13(12)16)10-9-14-6-3-2-4-7-14/h12-13,16H,2-11H2,1H3.
What are the key properties of 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol?
3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol has a molecular weight of 226.36 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol is sourced from PubChem (CID 114502746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).