(2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane

C10H16O — CID 11708083

IUPAC(2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane
SMILESC=C1CCO[C@@H](C=C(C)C)C1
InChIInChI=1S/C10H16O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,10H,3-5,7H2,1-2H3/t10-/m0/s1
InChIKeyJRIATCFPZFOVNP-JTQLQIEISA-N
MW152.24 g/mol
LogP2.69
Rot. Bonds1

About (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane

(2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane (PubChem CID 11708083) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane.

Molecular Properties

Compound Name(2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane
PubChem CID11708083
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane
SMILESC=C1CCO[C@@H](C=C(C)C)C1
InChIInChI=1S/C10H16O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,10H,3-5,7H2,1-2H3/t10-/m0/s1
InChIKeyJRIATCFPZFOVNP-JTQLQIEISA-N
XLogP2.69
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 ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Rose oxide
CID 27866
(+-)-Nerol oxide
CID 61275
Rose oxide, cis-(-)-
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Rose oxide, cis-(+)-
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Rose oxide, trans-(-)-
CID 7093102
2H-Pyran, 6-butyl-3,6-dihydro-2,4-dimethyl-
CID 91147
2,4,5,7a-Tetrahydro-3,6-dimethylbenzofuran
CID 21606187
2-Butyl-5,6-dihydro-2,4-dimethyl-2H-pyran
CID 3017306
2H-Pyran, 3,6-dihydro-4-(4-methyl-3-penten-1-yl)-
CID 91909
Rose oxide, trans-(+)-
CID 1712086
(6E,10E,14E)-3,6,10,14-tetramethyl-2,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan
CID 23425614
2H-Pyran, 2-butyl-3,6-dihydro-4,6-dimethyl-
CID 91148

Frequently Asked Questions

What is the IUPAC name of (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane?
The IUPAC name of (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane (CID 11708083) is (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane.
What is the SMILES notation for (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane?
The canonical SMILES for (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane is C=C1CCO[C@@H](C=C(C)C)C1.
What is the InChIKey of (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane?
The InChIKey is JRIATCFPZFOVNP-JTQLQIEISA-N. The full InChI is InChI=1S/C10H16O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,10H,3-5,7H2,1-2H3/t10-/m0/s1.
What are the key properties of (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane?
(2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane has a molecular weight of 152.24 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methylidene-2-(2-methylprop-1-enyl)oxane is sourced from PubChem (CID 11708083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).