3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol

C11H20O2 — CID 18783519

IUPAC3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol
SMILESCCCC1=CC(CCC)COC1O
InChIInChI=1S/C11H20O2/c1-3-5-9-7-10(6-4-2)11(12)13-8-9/h7,9,11-12H,3-6,8H2,1-2H3
InChIKeyFENZCGRPTYLHSD-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.48
Rot. Bonds4

About 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol

3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol (PubChem CID 18783519) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol.

Molecular Properties

Compound Name3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol
PubChem CID18783519
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol
SMILESCCCC1=CC(CCC)COC1O
InChIInChI=1S/C11H20O2/c1-3-5-9-7-10(6-4-2)11(12)13-8-9/h7,9,11-12H,3-6,8H2,1-2H3
InChIKeyFENZCGRPTYLHSD-UHFFFAOYSA-N
XLogP2.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol?
The IUPAC name of 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol (CID 18783519) is 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol.
What is the SMILES notation for 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol?
The canonical SMILES for 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol is CCCC1=CC(CCC)COC1O.
What is the InChIKey of 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol?
The InChIKey is FENZCGRPTYLHSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-5-9-7-10(6-4-2)11(12)13-8-9/h7,9,11-12H,3-6,8H2,1-2H3.
What are the key properties of 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol?
3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol has a molecular weight of 184.28 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dipropyl-3,6-dihydro-2H-pyran-6-ol is sourced from PubChem (CID 18783519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).