(1-pyrimidin-2-ylpiperidin-4-yl)methanol

C10H15N3O — CID 2776521

IUPAC(1-pyrimidin-2-ylpiperidin-4-yl)methanol
SMILESOCC1CCN(c2ncccn2)CC1
InChIInChI=1S/C10H15N3O/c14-8-9-2-6-13(7-3-9)10-11-4-1-5-12-10/h1,4-5,9,14H,2-3,6-8H2
InChIKeyZUNGTEUNVMHDIX-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.69
Rot. Bonds2

About (1-pyrimidin-2-ylpiperidin-4-yl)methanol

(1-pyrimidin-2-ylpiperidin-4-yl)methanol (PubChem CID 2776521) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is (1-pyrimidin-2-ylpiperidin-4-yl)methanol.

Molecular Properties

Compound Name(1-pyrimidin-2-ylpiperidin-4-yl)methanol
PubChem CID2776521
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name(1-pyrimidin-2-ylpiperidin-4-yl)methanol
SMILESOCC1CCN(c2ncccn2)CC1
InChIInChI=1S/C10H15N3O/c14-8-9-2-6-13(7-3-9)10-11-4-1-5-12-10/h1,4-5,9,14H,2-3,6-8H2
InChIKeyZUNGTEUNVMHDIX-UHFFFAOYSA-N
XLogP0.69
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1-pyrimidin-2-ylpiperidin-4-yl)methanol?
The IUPAC name of (1-pyrimidin-2-ylpiperidin-4-yl)methanol (CID 2776521) is (1-pyrimidin-2-ylpiperidin-4-yl)methanol.
What is the SMILES notation for (1-pyrimidin-2-ylpiperidin-4-yl)methanol?
The canonical SMILES for (1-pyrimidin-2-ylpiperidin-4-yl)methanol is OCC1CCN(c2ncccn2)CC1.
What is the InChIKey of (1-pyrimidin-2-ylpiperidin-4-yl)methanol?
The InChIKey is ZUNGTEUNVMHDIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c14-8-9-2-6-13(7-3-9)10-11-4-1-5-12-10/h1,4-5,9,14H,2-3,6-8H2.
What are the key properties of (1-pyrimidin-2-ylpiperidin-4-yl)methanol?
(1-pyrimidin-2-ylpiperidin-4-yl)methanol has a molecular weight of 193.25 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-pyrimidin-2-ylpiperidin-4-yl)methanol is sourced from PubChem (CID 2776521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).