2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran

C11H20O — CID 567148

IUPAC2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran
SMILESCCC1=C(C)CC(C)C(CC)O1
InChIInChI=1S/C11H20O/c1-5-10-8(3)7-9(4)11(6-2)12-10/h8,10H,5-7H2,1-4H3
InChIKeyDCFJGGUMNKFZSD-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.51
Rot. Bonds2

About 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran

2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran (PubChem CID 567148) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran
PubChem CID567148
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran
SMILESCCC1=C(C)CC(C)C(CC)O1
InChIInChI=1S/C11H20O/c1-5-10-8(3)7-9(4)11(6-2)12-10/h8,10H,5-7H2,1-4H3
InChIKeyDCFJGGUMNKFZSD-UHFFFAOYSA-N
XLogP3.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran?
The IUPAC name of 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran (CID 567148) is 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran.
What is the SMILES notation for 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran?
The canonical SMILES for 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran is CCC1=C(C)CC(C)C(CC)O1.
What is the InChIKey of 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran?
The InChIKey is DCFJGGUMNKFZSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-5-10-8(3)7-9(4)11(6-2)12-10/h8,10H,5-7H2,1-4H3.
What are the key properties of 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran?
2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran has a molecular weight of 168.28 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-3,5-dimethyl-3,4-dihydro-2H-pyran is sourced from PubChem (CID 567148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).