6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran

C10H14O — CID 123155935

IUPAC6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran
SMILESC=CCC1C=CC(=C)C(C)O1
InChIInChI=1S/C10H14O/c1-4-5-10-7-6-8(2)9(3)11-10/h4,6-7,9-10H,1-2,5H2,3H3
InChIKeyHMRXAUUIRLRZBL-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.46
Rot. Bonds2

About 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran

6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran (PubChem CID 123155935) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran.

Molecular Properties

Compound Name6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran
PubChem CID123155935
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran
SMILESC=CCC1C=CC(=C)C(C)O1
InChIInChI=1S/C10H14O/c1-4-5-10-7-6-8(2)9(3)11-10/h4,6-7,9-10H,1-2,5H2,3H3
InChIKeyHMRXAUUIRLRZBL-UHFFFAOYSA-N
XLogP2.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran?
The IUPAC name of 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran (CID 123155935) is 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran.
What is the SMILES notation for 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran?
The canonical SMILES for 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran is C=CCC1C=CC(=C)C(C)O1.
What is the InChIKey of 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran?
The InChIKey is HMRXAUUIRLRZBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O/c1-4-5-10-7-6-8(2)9(3)11-10/h4,6-7,9-10H,1-2,5H2,3H3.
What are the key properties of 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran?
6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran has a molecular weight of 150.22 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-methylidene-2-prop-2-enyl-2H-pyran is sourced from PubChem (CID 123155935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).