1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol

C11H19NO2 — CID 115879755

IUPAC1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol
SMILESOC1CCCN(CC2=CCCOC2)C1
InChIInChI=1S/C11H19NO2/c13-11-4-1-5-12(8-11)7-10-3-2-6-14-9-10/h3,11,13H,1-2,4-9H2
InChIKeyFOYAQSQFTGFQPW-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.79
Rot. Bonds2

About 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol

1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol (PubChem CID 115879755) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol
PubChem CID115879755
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol
SMILESOC1CCCN(CC2=CCCOC2)C1
InChIInChI=1S/C11H19NO2/c13-11-4-1-5-12(8-11)7-10-3-2-6-14-9-10/h3,11,13H,1-2,4-9H2
InChIKeyFOYAQSQFTGFQPW-UHFFFAOYSA-N
XLogP0.79
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(3-Cyclohexa-2,5-dien-1-yloxypropyl)piperidin-4-ol
CID 90953626
[1-(3,6-dihydro-2H-pyran-5-ylmethyl)-4-methylpiperidin-4-yl]methanol
CID 104695274
2-[3,6-dihydro-2H-pyran-5-ylmethyl(pentyl)amino]ethanol
CID 109927164
[1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-4-yl]methanol
CID 109927350
1-[1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-4-yl]ethanol
CID 109931640
1-[1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-2-yl]ethanol
CID 109931768
1-[cyclohexyl(3,6-dihydro-2H-pyran-5-ylmethyl)amino]propan-2-ol
CID 109931824
[1-(3,6-dihydro-2H-pyran-5-ylmethyl)-4-ethylpiperidin-4-yl]methanol
CID 109935156
[1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-2-yl]methanol
CID 115879659
(3R)-1-(3,6-dihydro-2H-pyran-5-ylmethyl)pyrrolidin-3-ol
CID 127009463
1-[3,6-dihydro-2H-pyran-5-ylmethyl(methyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 132303810
4-[[3,6-dihydro-2H-pyran-5-ylmethyl(methyl)amino]methyl]oxan-4-ol
CID 132307694

Frequently Asked Questions

What is the IUPAC name of 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol?
The IUPAC name of 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol (CID 115879755) is 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol.
What is the SMILES notation for 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol?
The canonical SMILES for 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol is OC1CCCN(CC2=CCCOC2)C1.
What is the InChIKey of 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol?
The InChIKey is FOYAQSQFTGFQPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-11-4-1-5-12(8-11)7-10-3-2-6-14-9-10/h3,11,13H,1-2,4-9H2.
What are the key properties of 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol?
1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol has a molecular weight of 197.28 g/mol, XLogP of 0.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,6-dihydro-2H-pyran-5-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 115879755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).