2,2-dimethyl-6-prop-1-en-2-ylpyran

C10H14O — CID 636526

IUPAC2,2-dimethyl-6-prop-1-en-2-ylpyran
SMILESC=C(C)C1=CC=CC(C)(C)O1
InChIInChI=1S/C10H14O/c1-8(2)9-6-5-7-10(3,4)11-9/h5-7H,1H2,2-4H3
InChIKeyHNVSTMZBBLAYKR-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.81
Rot. Bonds1

About 2,2-dimethyl-6-prop-1-en-2-ylpyran

2,2-dimethyl-6-prop-1-en-2-ylpyran (PubChem CID 636526) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is 2,2-dimethyl-6-prop-1-en-2-ylpyran.

Molecular Properties

Compound Name2,2-dimethyl-6-prop-1-en-2-ylpyran
PubChem CID636526
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name2,2-dimethyl-6-prop-1-en-2-ylpyran
SMILESC=C(C)C1=CC=CC(C)(C)O1
InChIInChI=1S/C10H14O/c1-8(2)9-6-5-7-10(3,4)11-9/h5-7H,1H2,2-4H3
InChIKeyHNVSTMZBBLAYKR-UHFFFAOYSA-N
XLogP2.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Magnesium bromide 4-methoxy-3,5-dimethylbenzen-1-ide (1/1/1)
CID 12914311
2,2,4,6-Tetramethyl-2H-pyran
CID 12240309
Lithium 1-methoxy-4-methylbenzene-6-ide
CID 10887914
Magnesium bromide 4-methoxy-2-methylbenzen-1-ide (1/1/1)
CID 10933159
Lithium 1-methoxy-3-methylbenzene-4-ide
CID 14790499
Lithium 1-methoxy-3,5-dimethylbenzene-4-ide
CID 14943724
2,2-Dimethyl-2h-pyran
CID 15446431
5-Methyl-oxine
CID 18410493
Dimethylpyran
CID 20253317
2,4-Dimethyl-6-methylidenepyran
CID 20660053
5,6-dimethyl-2H-pyran
CID 54229426
2-methoxy-5H-indene
CID 136000266

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-prop-1-en-2-ylpyran?
The IUPAC name of 2,2-dimethyl-6-prop-1-en-2-ylpyran (CID 636526) is 2,2-dimethyl-6-prop-1-en-2-ylpyran.
What is the SMILES notation for 2,2-dimethyl-6-prop-1-en-2-ylpyran?
The canonical SMILES for 2,2-dimethyl-6-prop-1-en-2-ylpyran is C=C(C)C1=CC=CC(C)(C)O1.
What is the InChIKey of 2,2-dimethyl-6-prop-1-en-2-ylpyran?
The InChIKey is HNVSTMZBBLAYKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O/c1-8(2)9-6-5-7-10(3,4)11-9/h5-7H,1H2,2-4H3.
What are the key properties of 2,2-dimethyl-6-prop-1-en-2-ylpyran?
2,2-dimethyl-6-prop-1-en-2-ylpyran has a molecular weight of 150.22 g/mol, XLogP of 2.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-prop-1-en-2-ylpyran is sourced from PubChem (CID 636526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).