2-[(2R)-2-methyl-5-methylideneheptoxy]oxane

C14H26O2 — CID 10353666

IUPAC2-[(2R)-2-methyl-5-methylideneheptoxy]oxane
SMILESC=C(CC)CC[C@@H](C)COC1CCCCO1
InChIInChI=1S/C14H26O2/c1-4-12(2)8-9-13(3)11-16-14-7-5-6-10-15-14/h13-14H,2,4-11H2,1,3H3/t13-,14?/m1/s1
InChIKeyYDAWUIQROLZBQE-KWCCSABGSA-N
MW226.36 g/mol
LogP3.91
Rot. Bonds7

About 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane

2-[(2R)-2-methyl-5-methylideneheptoxy]oxane (PubChem CID 10353666) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane.

Molecular Properties

Compound Name2-[(2R)-2-methyl-5-methylideneheptoxy]oxane
PubChem CID10353666
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name2-[(2R)-2-methyl-5-methylideneheptoxy]oxane
SMILESC=C(CC)CC[C@@H](C)COC1CCCCO1
InChIInChI=1S/C14H26O2/c1-4-12(2)8-9-13(3)11-16-14-7-5-6-10-15-14/h13-14H,2,4-11H2,1,3H3/t13-,14?/m1/s1
InChIKeyYDAWUIQROLZBQE-KWCCSABGSA-N
XLogP3.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-Isopropenyl-5-methylcyclopentylmethoxy)tetrahydropyran
CID 559128
2-[(4R)-4-methylundec-10-enoxy]oxane
CID 56653144
2-[(2S)-2-methylhept-6-enoxy]oxane
CID 11252841
6-Isobutyl-4-methylene-2-ethoxytetrahydro-2h-pyran
CID 129746167
2-[(5R)-5-ethenylnonyl]-1,3-dioxane
CID 132602699
2-[(3R)-6-iodo-3-methyl-4-methylidenehexoxy]oxane
CID 134897740
2-(7-Methylnon-8-enoxy)oxane
CID 134966880
2-[(10R)-10-methylheptadec-16-enoxy]oxane
CID 135072499
(1R)-1-[3-(1-ethoxyethoxy)propyl]-2-methylidenecyclohexane
CID 139263560
8-(1-Ethoxyethoxy)-2,6-dimethyloct-1-ene
CID 113435
2-[(4-methylcyclohex-3-en-1-yl)methoxy]tetrahydro-2H-pyran
CID 3569245
2-[(2R)-2-methyloct-7-enoxy]oxane
CID 10585371

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane?
The IUPAC name of 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane (CID 10353666) is 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane.
What is the SMILES notation for 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane?
The canonical SMILES for 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane is C=C(CC)CC[C@@H](C)COC1CCCCO1.
What is the InChIKey of 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane?
The InChIKey is YDAWUIQROLZBQE-KWCCSABGSA-N. The full InChI is InChI=1S/C14H26O2/c1-4-12(2)8-9-13(3)11-16-14-7-5-6-10-15-14/h13-14H,2,4-11H2,1,3H3/t13-,14?/m1/s1.
What are the key properties of 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane?
2-[(2R)-2-methyl-5-methylideneheptoxy]oxane has a molecular weight of 226.36 g/mol, XLogP of 3.91, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-methyl-5-methylideneheptoxy]oxane is sourced from PubChem (CID 10353666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).