3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol

C10H18O2 — CID 130145039

IUPAC3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol
SMILESCC1(O)C(CCO)CC2CC21C
InChIInChI=1S/C10H18O2/c1-9-6-8(9)5-7(3-4-11)10(9,2)12/h7-8,11-12H,3-6H2,1-2H3
InChIKeyFCAYNWYVOLTVPL-UHFFFAOYSA-N
MW170.25 g/mol
LogP1.17
Rot. Bonds2

About 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol

3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol (PubChem CID 130145039) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol.

Molecular Properties

Compound Name3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol
PubChem CID130145039
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol
SMILESCC1(O)C(CCO)CC2CC21C
InChIInChI=1S/C10H18O2/c1-9-6-8(9)5-7(3-4-11)10(9,2)12/h7-8,11-12H,3-6H2,1-2H3
InChIKeyFCAYNWYVOLTVPL-UHFFFAOYSA-N
XLogP1.17
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methylidene-4-[(1S)-1,2,2-trimethyl-3-bicyclo[3.1.0]hexanyl]butan-1-ol
CID 164818451
2-(2-ethyl-2-methylcyclopropyl)ethanol
CID 72514759
2-[(1R,3R)-3-(hydroxymethyl)-2,2-dimethylcyclobutyl]ethanol
CID 10725629
cis-(1R,2R)-2-(2-hydroxyethyl)-1-propan-2-ylcyclopropan-1-ol
CID 131020192
2-[(5R)-6,6-dimethyl-3-bicyclo[3.1.1]heptanyl]ethanol
CID 89342976
[1-ethyl-2-[(1,2,2-trimethyl-3-bicyclo[3.1.0]hexanyl)methyl]cyclopropyl]methanol
CID 22096565
dimethyl 2-[2-[(1S)-1,2,2-trimethyl-3-bicyclo[3.1.0]hexanyl]ethyl]propanedioate
CID 164818449
1-tert-butyl-2-(2-hydroxyethyl)cyclobutan-1-ol
CID 86129641
2-[6-(2-hydroxyethyl)-2,2-dimethyl-1,3-dioxan-4-yl]ethanol
CID 71346024
2-(1,2,2-trimethylpyrrolidin-3-yl)ethanol
CID 117017383
2-(7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)ethanol;ethane
CID 142091721
(1S,2S,4R)-2-(hydroxymethyl)-1,4-dimethylcyclopentan-1-ol
CID 58944578

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol?
The IUPAC name of 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol (CID 130145039) is 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol.
What is the SMILES notation for 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol?
The canonical SMILES for 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol is CC1(O)C(CCO)CC2CC21C.
What is the InChIKey of 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol?
The InChIKey is FCAYNWYVOLTVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-9-6-8(9)5-7(3-4-11)10(9,2)12/h7-8,11-12H,3-6H2,1-2H3.
What are the key properties of 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol?
3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol has a molecular weight of 170.25 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyethyl)-1,2-dimethylbicyclo[3.1.0]hexan-2-ol is sourced from PubChem (CID 130145039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).