2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran

C10H14O2 — CID 147914000

IUPAC2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran
SMILESC1=CC(C2CCC=CO2)OCC1
InChIInChI=1S/C10H14O2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10/h1,4-5,8-10H,2-3,6-7H2
InChIKeyIGRVVWZLXMNDDD-UHFFFAOYSA-N
MW166.22 g/mol
LogP2.02
Rot. Bonds1

About 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran

2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran (PubChem CID 147914000) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran
PubChem CID147914000
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran
SMILESC1=CC(C2CCC=CO2)OCC1
InChIInChI=1S/C10H14O2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10/h1,4-5,8-10H,2-3,6-7H2
InChIKeyIGRVVWZLXMNDDD-UHFFFAOYSA-N
XLogP2.02
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.02
H-Bond Donors ≤ 50
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 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran?
The IUPAC name of 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran (CID 147914000) is 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran.
What is the SMILES notation for 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran?
The canonical SMILES for 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran is C1=CC(C2CCC=CO2)OCC1.
What is the InChIKey of 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran?
The InChIKey is IGRVVWZLXMNDDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10/h1,4-5,8-10H,2-3,6-7H2.
What are the key properties of 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran?
2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran has a molecular weight of 166.22 g/mol, XLogP of 2.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,6-dihydro-2H-pyran-6-yl)-3,4-dihydro-2H-pyran is sourced from PubChem (CID 147914000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).