methoxyethane;oxane;prop-1-ene

C11H24O2 — CID 145359295

IUPACmethoxyethane;oxane;prop-1-ene
SMILESC1CCOCC1.C=CC.CCOC
InChIInChI=1S/C5H10O.C3H8O.C3H6/c1-2-4-6-5-3-1;1-3-4-2;1-3-2/h1-5H2;3H2,1-2H3;3H,1H2,2H3
InChIKeyCRGHARVABRPWCG-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.03
Rot. Bonds1

About methoxyethane;oxane;prop-1-ene

methoxyethane;oxane;prop-1-ene (PubChem CID 145359295) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is methoxyethane;oxane;prop-1-ene.

Molecular Properties

Compound Namemethoxyethane;oxane;prop-1-ene
PubChem CID145359295
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Namemethoxyethane;oxane;prop-1-ene
SMILESC1CCOCC1.C=CC.CCOC
InChIInChI=1S/C5H10O.C3H8O.C3H6/c1-2-4-6-5-3-1;1-3-4-2;1-3-2/h1-5H2;3H2,1-2H3;3H,1H2,2H3
InChIKeyCRGHARVABRPWCG-UHFFFAOYSA-N
XLogP3.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.03
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

3-methoxyprop-1-ene;oxolane
CID 175033291
ethanol;oxane
CID 68981478
1-methoxypentane;oxolane
CID 160798368
oxane;oxepane;oxocane;oxolane
CID 159745968
cycloheptane;oxolane
CID 23033083
cyclobutane;oxolane
CID 158733546
oxacyclotetracosane
CID 57108486
oxacycloheptadecane
CID 22011753
cyclohexane;oxane
CID 20574508
oxolane;oxonane
CID 159283889
diethyl(methoxy)borane;oxolane
CID 158668575
oxolane;prop-2-en-1-ol
CID 67851867

Frequently Asked Questions

What is the IUPAC name of methoxyethane;oxane;prop-1-ene?
The IUPAC name of methoxyethane;oxane;prop-1-ene (CID 145359295) is methoxyethane;oxane;prop-1-ene.
What is the SMILES notation for methoxyethane;oxane;prop-1-ene?
The canonical SMILES for methoxyethane;oxane;prop-1-ene is C1CCOCC1.C=CC.CCOC.
What is the InChIKey of methoxyethane;oxane;prop-1-ene?
The InChIKey is CRGHARVABRPWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O.C3H8O.C3H6/c1-2-4-6-5-3-1;1-3-4-2;1-3-2/h1-5H2;3H2,1-2H3;3H,1H2,2H3.
What are the key properties of methoxyethane;oxane;prop-1-ene?
methoxyethane;oxane;prop-1-ene has a molecular weight of 188.31 g/mol, XLogP of 3.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxyethane;oxane;prop-1-ene is sourced from PubChem (CID 145359295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).