[(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol

C11H20O2 — CID 134961063

IUPAC[(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol
SMILESC=C[C@H]1CO[C@H](CC(C)C)[C@H]1CO
InChIInChI=1S/C11H20O2/c1-4-9-7-13-11(5-8(2)3)10(9)6-12/h4,8-12H,1,5-7H2,2-3H3/t9-,10-,11+/m0/s1
InChIKeyZXEYMPQOQULVON-GARJFASQSA-N
MW184.28 g/mol
LogP1.84
Rot. Bonds4

About [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol

[(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol (PubChem CID 134961063) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol.

Molecular Properties

Compound Name[(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol
PubChem CID134961063
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name[(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol
SMILESC=C[C@H]1CO[C@H](CC(C)C)[C@H]1CO
InChIInChI=1S/C11H20O2/c1-4-9-7-13-11(5-8(2)3)10(9)6-12/h4,8-12H,1,5-7H2,2-3H3/t9-,10-,11+/m0/s1
InChIKeyZXEYMPQOQULVON-GARJFASQSA-N
XLogP1.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol 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

(2R,3R,4R,5S)-4-ethenyl-4-fluoro-2-(2-methylpropyl)-5-propan-2-yloxolan-3-ol
CID 176613058
(3R,4R,7S,8S)-4,7-bis(ethenyl)decane-3,8-diol
CID 10443713
(3S,4S,5S,6R,7R,8R)-3,5,6,8-tetramethyldeca-1,9-diene-4,7-diol
CID 10857159
(2R)-2-[(2S,5S,6S)-6-[(2S)-but-3-en-2-yl]-5-methyloxan-2-yl]propan-1-ol
CID 16680391
(1R,2S,5S,6R)-2-ethyl-5,6-bis(hydroxymethyl)cyclohex-3-en-1-ol
CID 101472171
cis-2-Methyl-2-vinyl-(alpha-hydroxy-isopropyl)-tetrahydrofuran
CID 129848098
(1R,2S,5S,6R)-5,6-bis(methoxymethyl)-2-prop-1-en-2-ylcyclohex-3-en-1-ol
CID 134970929
(2R,3R)-7-methyl-2-prop-2-enyloctane-1,3-diol
CID 10584205
(1S,2R,5R,6S)-2-ethyl-5,6-bis(methoxymethyl)cyclohex-3-en-1-ol
CID 101241335
(1S,2R,5R,6S)-5,6-bis(methoxymethyl)-2-(2-methylpropyl)cyclohex-3-en-1-ol
CID 101241336
(2R,4R,5S)-5-ethenyl-2-(2-methylpropyl)oxan-4-ol
CID 101412809
(2R,3S)-2-[(2R,3S)-3-[(2S)-2-methylbut-3-enyl]oxiran-2-yl]pentan-3-ol
CID 58297741

Frequently Asked Questions

What is the IUPAC name of [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol?
The IUPAC name of [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol (CID 134961063) is [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol.
What is the SMILES notation for [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol?
The canonical SMILES for [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol is C=C[C@H]1CO[C@H](CC(C)C)[C@H]1CO.
What is the InChIKey of [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol?
The InChIKey is ZXEYMPQOQULVON-GARJFASQSA-N. The full InChI is InChI=1S/C11H20O2/c1-4-9-7-13-11(5-8(2)3)10(9)6-12/h4,8-12H,1,5-7H2,2-3H3/t9-,10-,11+/m0/s1.
What are the key properties of [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol?
[(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol has a molecular weight of 184.28 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R,4R)-4-ethenyl-2-(2-methylpropyl)oxolan-3-yl]methanol is sourced from PubChem (CID 134961063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).