(2R,3R)-3-methyl-2-pent-4-enyloxolane

C10H18O — CID 134951044

IUPAC(2R,3R)-3-methyl-2-pent-4-enyloxolane
SMILESC=CCCC[C@H]1OCC[C@H]1C
InChIInChI=1S/C10H18O/c1-3-4-5-6-10-9(2)7-8-11-10/h3,9-10H,1,4-8H2,2H3/t9-,10-/m1/s1
InChIKeyJQUYNIOEHFHEGD-NXEZZACHSA-N
MW154.25 g/mol
LogP2.77
Rot. Bonds4

About (2R,3R)-3-methyl-2-pent-4-enyloxolane

(2R,3R)-3-methyl-2-pent-4-enyloxolane (PubChem CID 134951044) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (2R,3R)-3-methyl-2-pent-4-enyloxolane.

Molecular Properties

Compound Name(2R,3R)-3-methyl-2-pent-4-enyloxolane
PubChem CID134951044
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(2R,3R)-3-methyl-2-pent-4-enyloxolane
SMILESC=CCCC[C@H]1OCC[C@H]1C
InChIInChI=1S/C10H18O/c1-3-4-5-6-10-9(2)7-8-11-10/h3,9-10H,1,4-8H2,2H3/t9-,10-/m1/s1
InChIKeyJQUYNIOEHFHEGD-NXEZZACHSA-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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2R,3R)-3-methyl-2-pent-4-enyloxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(7R,8S)-cis-7,8-epoxy-2-methyloctadec-17-ene
CID 56936246
2-[2-(4-Methylcyclohex-3-EN-1-YL)propyl]tetrahydrofuran
CID 3024253
cis-7,8-Epoxy-2-methyloctadec-17-ene
CID 76463834
Thromboxene
CID 57129285
(1-Methoxy-3-buten-1-yl)cyclohexane
CID 10442090
(2R,3S)-2-cyclohexyl-3-ethenyloxolane
CID 10877738
2-Prop-2-enyl-1-oxaspiro[4.5]decane
CID 14925029
[1-(Hexyloxy)but-3-EN-1-YL]cyclohexane
CID 15174029
4-Butyl-3-octyl-2-prop-2-enyloxolane
CID 15438011
(2R,3R,5R)-2-butyl-3-ethenyl-3-methyl-5-prop-2-enyloxolane
CID 16125788
(2R,3R,5R)-2-butyl-3-ethenyl-3-methyl-5-(2-methylprop-2-enyl)oxolane
CID 16125789
2-Methyl-4-(non-8-en-1-yl)oxolane
CID 71330222

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-3-methyl-2-pent-4-enyloxolane?
The IUPAC name of (2R,3R)-3-methyl-2-pent-4-enyloxolane (CID 134951044) is (2R,3R)-3-methyl-2-pent-4-enyloxolane.
What is the SMILES notation for (2R,3R)-3-methyl-2-pent-4-enyloxolane?
The canonical SMILES for (2R,3R)-3-methyl-2-pent-4-enyloxolane is C=CCCC[C@H]1OCC[C@H]1C.
What is the InChIKey of (2R,3R)-3-methyl-2-pent-4-enyloxolane?
The InChIKey is JQUYNIOEHFHEGD-NXEZZACHSA-N. The full InChI is InChI=1S/C10H18O/c1-3-4-5-6-10-9(2)7-8-11-10/h3,9-10H,1,4-8H2,2H3/t9-,10-/m1/s1.
What are the key properties of (2R,3R)-3-methyl-2-pent-4-enyloxolane?
(2R,3R)-3-methyl-2-pent-4-enyloxolane 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 (2R,3R)-3-methyl-2-pent-4-enyloxolane is sourced from PubChem (CID 134951044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).