3-prop-2-enyl-3-propyloxolane

C10H18O — CID 68879420

IUPAC3-prop-2-enyl-3-propyloxolane
SMILESC=CCC1(CCC)CCOC1
InChIInChI=1S/C10H18O/c1-3-5-10(6-4-2)7-8-11-9-10/h3H,1,4-9H2,2H3
InChIKeyUWKDIHWHPODTPW-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.77
Rot. Bonds4

About 3-prop-2-enyl-3-propyloxolane

3-prop-2-enyl-3-propyloxolane (PubChem CID 68879420) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 3-prop-2-enyl-3-propyloxolane.

Molecular Properties

Compound Name3-prop-2-enyl-3-propyloxolane
PubChem CID68879420
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name3-prop-2-enyl-3-propyloxolane
SMILESC=CCC1(CCC)CCOC1
InChIInChI=1S/C10H18O/c1-3-5-10(6-4-2)7-8-11-9-10/h3H,1,4-9H2,2H3
InChIKeyUWKDIHWHPODTPW-UHFFFAOYSA-N
XLogP2.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.77
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

4-but-3-enyl-4-propyloxane
CID 156531581
3-ethyl-3-prop-2-enyloxetane
CID 68640910
4-ethyl-4-propyloxane
CID 142221834
4-(3-methoxybutyl)-4-prop-2-enyloxane
CID 145019364
4-[(3-prop-2-enyloxolan-3-yl)methylsulfanyl]phenol
CID 59913125
1-octyl-1-prop-2-enylcyclopropane
CID 134979265
3-(bromomethyl)-3-nonyloxolane
CID 66050745
N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]-N-prop-2-enylprop-2-en-1-amine
CID 62262394
1-ethyl-1-prop-2-enylcyclobutane
CID 123404506
6a-methoxy-3a-prop-2-enyl-3,4,5,6-tetrahydro-2H-cyclopenta[b]furan
CID 11298330
2,2-dimethyl-5,5-bis(prop-2-enyl)-1,3-dioxane
CID 10932381
N-[(3-decyloxolan-3-yl)methyl]ethanamine
CID 63502132

Frequently Asked Questions

What is the IUPAC name of 3-prop-2-enyl-3-propyloxolane?
The IUPAC name of 3-prop-2-enyl-3-propyloxolane (CID 68879420) is 3-prop-2-enyl-3-propyloxolane.
What is the SMILES notation for 3-prop-2-enyl-3-propyloxolane?
The canonical SMILES for 3-prop-2-enyl-3-propyloxolane is C=CCC1(CCC)CCOC1.
What is the InChIKey of 3-prop-2-enyl-3-propyloxolane?
The InChIKey is UWKDIHWHPODTPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-3-5-10(6-4-2)7-8-11-9-10/h3H,1,4-9H2,2H3.
What are the key properties of 3-prop-2-enyl-3-propyloxolane?
3-prop-2-enyl-3-propyloxolane has a molecular weight of 154.25 g/mol, XLogP of 2.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-prop-2-enyl-3-propyloxolane is sourced from PubChem (CID 68879420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).