2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran

C11H20O — CID 58469898

IUPAC2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran
SMILESCC(C)C1CC=COC1C(C)C
InChIInChI=1S/C11H20O/c1-8(2)10-6-5-7-12-11(10)9(3)4/h5,7-11H,6H2,1-4H3
InChIKeyLMKIZHSDCYFFPC-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.22
Rot. Bonds2

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

2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran (PubChem CID 58469898) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran
PubChem CID58469898
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran
SMILESCC(C)C1CC=COC1C(C)C
InChIInChI=1S/C11H20O/c1-8(2)10-6-5-7-12-11(10)9(3)4/h5,7-11H,6H2,1-4H3
InChIKeyLMKIZHSDCYFFPC-UHFFFAOYSA-N
XLogP3.22
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 ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran?
The IUPAC name of 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran (CID 58469898) is 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran.
What is the SMILES notation for 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran?
The canonical SMILES for 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran is CC(C)C1CC=COC1C(C)C.
What is the InChIKey of 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran?
The InChIKey is LMKIZHSDCYFFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-8(2)10-6-5-7-12-11(10)9(3)4/h5,7-11H,6H2,1-4H3.
What are the key properties of 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran?
2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran has a molecular weight of 168.28 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-di(propan-2-yl)-3,4-dihydro-2H-pyran is sourced from PubChem (CID 58469898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).