[1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol

C11H17N3O — CID 62699790

IUPAC[1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol
SMILESOCC1CCN(Cc2ncccn2)CC1
InChIInChI=1S/C11H17N3O/c15-9-10-2-6-14(7-3-10)8-11-12-4-1-5-13-11/h1,4-5,10,15H,2-3,6-9H2
InChIKeyKXZJQZJDUGZCFO-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.68
Rot. Bonds3

About [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol

[1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol (PubChem CID 62699790) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol
PubChem CID62699790
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name[1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol
SMILESOCC1CCN(Cc2ncccn2)CC1
InChIInChI=1S/C11H17N3O/c15-9-10-2-6-14(7-3-10)8-11-12-4-1-5-13-11/h1,4-5,10,15H,2-3,6-9H2
InChIKeyKXZJQZJDUGZCFO-UHFFFAOYSA-N
XLogP0.68
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol 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 [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol?
The IUPAC name of [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol (CID 62699790) is [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol is OCC1CCN(Cc2ncccn2)CC1.
What is the InChIKey of [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol?
The InChIKey is KXZJQZJDUGZCFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c15-9-10-2-6-14(7-3-10)8-11-12-4-1-5-13-11/h1,4-5,10,15H,2-3,6-9H2.
What are the key properties of [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol?
[1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol has a molecular weight of 207.28 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(pyrimidin-2-ylmethyl)piperidin-4-yl]methanol is sourced from PubChem (CID 62699790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).