2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane

C15H26O3 — CID 142140596

IUPAC2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane
SMILESC=C(OCC1CCOC(C)C1)C1CCOC(C)C1
InChIInChI=1S/C15H26O3/c1-11-8-14(4-6-16-11)10-18-13(3)15-5-7-17-12(2)9-15/h11-12,14-15H,3-10H2,1-2H3
InChIKeyMJEJUSUGRCWFLY-UHFFFAOYSA-N
MW254.37 g/mol
LogP3.15
Rot. Bonds4

About 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane

2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane (PubChem CID 142140596) has the molecular formula C15H26O3 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane.

Molecular Properties

Compound Name2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane
PubChem CID142140596
Molecular FormulaC15H26O3
Molecular Weight254.37 g/mol
Exact Mass254.19
IUPAC Name2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane
SMILESC=C(OCC1CCOC(C)C1)C1CCOC(C)C1
InChIInChI=1S/C15H26O3/c1-11-8-14(4-6-16-11)10-18-13(3)15-5-7-17-12(2)9-15/h11-12,14-15H,3-10H2,1-2H3
InChIKeyMJEJUSUGRCWFLY-UHFFFAOYSA-N
XLogP3.15
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

(r)-5-Ethyl-2-methylene-tetrahydro-pyran
CID 14892305
3,4,6-Trimethyl-2-methylideneoxane
CID 20614547
(2R,3R)-2,3-dimethyl-6-methylideneoxane
CID 58223661
5-ethoxy-2-ethyl-3,4-dimethyl-3,4-dihydro-2H-pyran
CID 67917175
2-Methyl-4-prop-1-en-2-yloxane
CID 68321307
2,3-Dimethyl-6-methylideneoxane
CID 76707743
(2S,4R)-2,4-dimethyl-6-methylideneoxane
CID 89243381
(2R)-2-methyl-4-prop-1-en-2-yloxane
CID 90152455
4-(1-Ethoxyethenyl)oxane
CID 117636259
2-Methyl-4-[1-[5-(6-methyloxan-3-yl)pentan-2-yloxy]ethenyl]oxane
CID 143224382
2-Methyl-4-(non-1-en-2-yloxymethyl)oxane
CID 143295918
Ethane;4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane
CID 143374558

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane?
The IUPAC name of 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane (CID 142140596) is 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane.
What is the SMILES notation for 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane?
The canonical SMILES for 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane is C=C(OCC1CCOC(C)C1)C1CCOC(C)C1.
What is the InChIKey of 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane?
The InChIKey is MJEJUSUGRCWFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O3/c1-11-8-14(4-6-16-11)10-18-13(3)15-5-7-17-12(2)9-15/h11-12,14-15H,3-10H2,1-2H3.
What are the key properties of 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane?
2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane has a molecular weight of 254.37 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane is sourced from PubChem (CID 142140596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).