(1-hydroxypiperidin-2-yl)methanol

C6H13NO2 — CID 91286383

IUPAC(1-hydroxypiperidin-2-yl)methanol
SMILESOCC1CCCCN1O
InChIInChI=1S/C6H13NO2/c8-5-6-3-1-2-4-7(6)9/h6,8-9H,1-5H2
InChIKeyXIRPBQNRBONGQR-UHFFFAOYSA-N
MW131.18 g/mol
LogP0.22
Rot. Bonds1

About (1-hydroxypiperidin-2-yl)methanol

(1-hydroxypiperidin-2-yl)methanol (PubChem CID 91286383) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is (1-hydroxypiperidin-2-yl)methanol.

Molecular Properties

Compound Name(1-hydroxypiperidin-2-yl)methanol
PubChem CID91286383
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name(1-hydroxypiperidin-2-yl)methanol
SMILESOCC1CCCCN1O
InChIInChI=1S/C6H13NO2/c8-5-6-3-1-2-4-7(6)9/h6,8-9H,1-5H2
InChIKeyXIRPBQNRBONGQR-UHFFFAOYSA-N
XLogP0.22
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-hydroxypiperidin-2-yl)methanol?
The IUPAC name of (1-hydroxypiperidin-2-yl)methanol (CID 91286383) is (1-hydroxypiperidin-2-yl)methanol.
What is the SMILES notation for (1-hydroxypiperidin-2-yl)methanol?
The canonical SMILES for (1-hydroxypiperidin-2-yl)methanol is OCC1CCCCN1O.
What is the InChIKey of (1-hydroxypiperidin-2-yl)methanol?
The InChIKey is XIRPBQNRBONGQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c8-5-6-3-1-2-4-7(6)9/h6,8-9H,1-5H2.
What are the key properties of (1-hydroxypiperidin-2-yl)methanol?
(1-hydroxypiperidin-2-yl)methanol has a molecular weight of 131.18 g/mol, XLogP of 0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-hydroxypiperidin-2-yl)methanol is sourced from PubChem (CID 91286383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).