2-methyl-5-(pent-4-enoxymethyl)oxolane

C11H20O2 — CID 178049912

IUPAC2-methyl-5-(pent-4-enoxymethyl)oxolane
SMILESC=CCCCOCC1CCC(C)O1
InChIInChI=1S/C11H20O2/c1-3-4-5-8-12-9-11-7-6-10(2)13-11/h3,10-11H,1,4-9H2,2H3
InChIKeyIDUKRDNDGLSXDE-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.54
Rot. Bonds6

About 2-methyl-5-(pent-4-enoxymethyl)oxolane

2-methyl-5-(pent-4-enoxymethyl)oxolane (PubChem CID 178049912) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-methyl-5-(pent-4-enoxymethyl)oxolane.

Molecular Properties

Compound Name2-methyl-5-(pent-4-enoxymethyl)oxolane
PubChem CID178049912
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2-methyl-5-(pent-4-enoxymethyl)oxolane
SMILESC=CCCCOCC1CCC(C)O1
InChIInChI=1S/C11H20O2/c1-3-4-5-8-12-9-11-7-6-10(2)13-11/h3,10-11H,1,4-9H2,2H3
InChIKeyIDUKRDNDGLSXDE-UHFFFAOYSA-N
XLogP2.54
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-But-3-enyl-5-(methoxymethyl)oxolane
CID 102309291
2-[1-[1-(Oxolan-2-yl)but-3-enoxy]but-3-enyl]oxolane
CID 56997051
6,7-Dimethoxyhept-1-ene
CID 57294939
2-(1-Methoxyprop-2-enyl)oxolane
CID 70232597
1,2-Bis(pent-4-enoxy)hexane
CID 71465045
(2R,3S,5S)-5-methyl-3-propan-2-yloxy-2-[(1R)-1-propan-2-yloxybut-3-enyl]oxolane
CID 117648715
(2R,3S,5S)-5-methyl-3-propan-2-yloxy-2-[(1S)-1-propan-2-yloxybut-3-enyl]oxolane
CID 117648779
(2S)-2-ethenyl-5-(methoxymethyl)oxolane
CID 118017231
2,5-Bis(1-methoxyethenyl)oxolane
CID 118047548
3-Ethoxy-2-(1-ethoxyethyl)-5-methylideneoxolane
CID 143529399
(2S,5S)-2-methyl-5-(7-methyloct-7-enoxymethyl)oxolane
CID 166779909
2-Methyl-5-(prop-2-enoxymethyl)oxolane
CID 171807573

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(pent-4-enoxymethyl)oxolane?
The IUPAC name of 2-methyl-5-(pent-4-enoxymethyl)oxolane (CID 178049912) is 2-methyl-5-(pent-4-enoxymethyl)oxolane.
What is the SMILES notation for 2-methyl-5-(pent-4-enoxymethyl)oxolane?
The canonical SMILES for 2-methyl-5-(pent-4-enoxymethyl)oxolane is C=CCCCOCC1CCC(C)O1.
What is the InChIKey of 2-methyl-5-(pent-4-enoxymethyl)oxolane?
The InChIKey is IDUKRDNDGLSXDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-4-5-8-12-9-11-7-6-10(2)13-11/h3,10-11H,1,4-9H2,2H3.
What are the key properties of 2-methyl-5-(pent-4-enoxymethyl)oxolane?
2-methyl-5-(pent-4-enoxymethyl)oxolane has a molecular weight of 184.28 g/mol, XLogP of 2.54, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(pent-4-enoxymethyl)oxolane is sourced from PubChem (CID 178049912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).