(2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol

C10H18O2 — CID 162923110

IUPAC(2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol
SMILESC=C[C@]1(C)CC[C@@H]([C@H](C)CO)O1
InChIInChI=1S/C10H18O2/c1-4-10(3)6-5-9(12-10)8(2)7-11/h4,8-9,11H,1,5-7H2,2-3H3/t8-,9+,10-/m1/s1
InChIKeyVUEGXHXUMOZKKN-KXUCPTDWSA-N
MW170.25 g/mol
LogP1.74
Rot. Bonds3

About (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol

(2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol (PubChem CID 162923110) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol
PubChem CID162923110
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name(2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol
SMILESC=C[C@]1(C)CC[C@@H]([C@H](C)CO)O1
InChIInChI=1S/C10H18O2/c1-4-10(3)6-5-9(12-10)8(2)7-11/h4,8-9,11H,1,5-7H2,2-3H3/t8-,9+,10-/m1/s1
InChIKeyVUEGXHXUMOZKKN-KXUCPTDWSA-N
XLogP1.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol with MolForge

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Related Compounds

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(E,2S,5R)-7-[(2S)-2-methyloxolan-2-yl]-5-propan-2-ylhept-6-en-2-ol
CID 162905306
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CID 57500616
5-Ethenyltetrahydro-beta,5-dimethyl-alpha-(3-methyl-2-butenyl)-2-furanethanol
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3-(5-Methyl-5-vinyltetrahydrofuran-2-yl)butan-2-ol
CID 75094173
Davanaether I
CID 91748591
2-Ethenyl-2-methyl-5-(propan-2-yl)oxolane
CID 14040251
(3R)-3-[(2S,5R)-5-ethenyl-5-methyloxolan-2-yl]butan-2-ol
CID 45113877
(2R)-2-[(2S,5R)-5-ethenyl-5-methyloxolan-2-yl]-6-methylhept-5-en-3-ol
CID 134833061
(2R)-2-[(2S,5R)-5-ethenyl-5-methyloxolan-2-yl]-4,4-dimethylhex-5-en-3-ol
CID 134861453
(E)-2,6-dimethyl-8-(oxolan-2-yl)oct-7-en-2-ol
CID 138975678

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol?
The IUPAC name of (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol (CID 162923110) is (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol.
What is the SMILES notation for (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol?
The canonical SMILES for (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol is C=C[C@]1(C)CC[C@@H]([C@H](C)CO)O1.
What is the InChIKey of (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol?
The InChIKey is VUEGXHXUMOZKKN-KXUCPTDWSA-N. The full InChI is InChI=1S/C10H18O2/c1-4-10(3)6-5-9(12-10)8(2)7-11/h4,8-9,11H,1,5-7H2,2-3H3/t8-,9+,10-/m1/s1.
What are the key properties of (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol?
(2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol has a molecular weight of 170.25 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol is sourced from PubChem (CID 162923110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).