(1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol

C8H14O2 — CID 130456562

IUPAC(1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol
SMILESC=C[C@H]1CC[C@H](O)[C@]1(C)O
InChIInChI=1S/C8H14O2/c1-3-6-4-5-7(9)8(6,2)10/h3,6-7,9-10H,1,4-5H2,2H3/t6-,7-,8+/m0/s1
InChIKeyOKOQQWYRWJNVDG-BIIVOSGPSA-N
MW142.20 g/mol
LogP0.69
Rot. Bonds1

About (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol

(1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol (PubChem CID 130456562) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol.

Molecular Properties

Compound Name(1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol
PubChem CID130456562
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name(1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol
SMILESC=C[C@H]1CC[C@H](O)[C@]1(C)O
InChIInChI=1S/C8H14O2/c1-3-6-4-5-7(9)8(6,2)10/h3,6-7,9-10H,1,4-5H2,2H3/t6-,7-,8+/m0/s1
InChIKeyOKOQQWYRWJNVDG-BIIVOSGPSA-N
XLogP0.69
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-ethenyl-2,4-dimethylcyclohexan-1-ol
CID 58534253
3-ethenyl-2,2-dimethyloxolane
CID 70126391
(1S,2R,4R)-1,2-bis(ethenyl)-1-methyl-4-prop-1-en-2-ylcyclohexane
CID 132988527
(2-ethenyl-1-methylcyclobutyl)silane
CID 173136645
trans-(1R,2R)-1-methyl-2-pent-4-enylcyclopropan-1-ol
CID 68751280
(4aS,5aR,6S,9S,9aS,10aS)-6,9-bis(ethenyl)-5a,9a-dimethyl-1,2,3,4,4a,6,7,8,9,10a-decahydrodibenzo-p-dioxin
CID 11737483
1,5,5,6-tetramethylcyclohexane-1,2-diol
CID 130145073
cis-(1R,2S)-2-ethenyl-1-propan-2-ylcyclopentan-1-ol
CID 102462779
(5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol
CID 138606754
(4S,7S)-4,7-bis(ethenyl)-1-oxaspiro[2.4]heptane
CID 11240580
(2R)-1-methylcyclobutane-1,2-diol
CID 130694777
1-[(2S,5S)-2,5-bis(ethenyl)-1-methylcyclopentyl]-4-bromobenzene
CID 10924264

Frequently Asked Questions

What is the IUPAC name of (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol?
The IUPAC name of (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol (CID 130456562) is (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol.
What is the SMILES notation for (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol?
The canonical SMILES for (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol is C=C[C@H]1CC[C@H](O)[C@]1(C)O.
What is the InChIKey of (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol?
The InChIKey is OKOQQWYRWJNVDG-BIIVOSGPSA-N. The full InChI is InChI=1S/C8H14O2/c1-3-6-4-5-7(9)8(6,2)10/h3,6-7,9-10H,1,4-5H2,2H3/t6-,7-,8+/m0/s1.
What are the key properties of (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol?
(1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol has a molecular weight of 142.20 g/mol, XLogP of 0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol is sourced from PubChem (CID 130456562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).