2,3-dimethyl-6-propan-2-yl-4H-pyran

C10H16O — CID 12070933

IUPAC2,3-dimethyl-6-propan-2-yl-4H-pyran
SMILESCC1=C(C)OC(C(C)C)=CC1
InChIInChI=1S/C10H16O/c1-7(2)10-6-5-8(3)9(4)11-10/h6-7H,5H2,1-4H3
InChIKeySWNKFDXTSKNDOZ-UHFFFAOYSA-N
MW152.24 g/mol
LogP3.24
Rot. Bonds1

About 2,3-dimethyl-6-propan-2-yl-4H-pyran

2,3-dimethyl-6-propan-2-yl-4H-pyran (PubChem CID 12070933) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 2,3-dimethyl-6-propan-2-yl-4H-pyran.

Molecular Properties

Compound Name2,3-dimethyl-6-propan-2-yl-4H-pyran
PubChem CID12070933
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name2,3-dimethyl-6-propan-2-yl-4H-pyran
SMILESCC1=C(C)OC(C(C)C)=CC1
InChIInChI=1S/C10H16O/c1-7(2)10-6-5-8(3)9(4)11-10/h6-7H,5H2,1-4H3
InChIKeySWNKFDXTSKNDOZ-UHFFFAOYSA-N
XLogP3.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-propan-2-yl-4H-pyran?
The IUPAC name of 2,3-dimethyl-6-propan-2-yl-4H-pyran (CID 12070933) is 2,3-dimethyl-6-propan-2-yl-4H-pyran.
What is the SMILES notation for 2,3-dimethyl-6-propan-2-yl-4H-pyran?
The canonical SMILES for 2,3-dimethyl-6-propan-2-yl-4H-pyran is CC1=C(C)OC(C(C)C)=CC1.
What is the InChIKey of 2,3-dimethyl-6-propan-2-yl-4H-pyran?
The InChIKey is SWNKFDXTSKNDOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-7(2)10-6-5-8(3)9(4)11-10/h6-7H,5H2,1-4H3.
What are the key properties of 2,3-dimethyl-6-propan-2-yl-4H-pyran?
2,3-dimethyl-6-propan-2-yl-4H-pyran has a molecular weight of 152.24 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-propan-2-yl-4H-pyran is sourced from PubChem (CID 12070933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).