2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol

C13H22O2 — CID 79558980

IUPAC2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol
SMILESOC(CC1CC2CCC1C2)C1CCCO1
InChIInChI=1S/C13H22O2/c14-12(13-2-1-5-15-13)8-11-7-9-3-4-10(11)6-9/h9-14H,1-8H2
InChIKeySIWVYZMSHFOWKA-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.35
Rot. Bonds3

About 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol

2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol (PubChem CID 79558980) has the molecular formula C13H22O2 and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol
PubChem CID79558980
Molecular FormulaC13H22O2
Molecular Weight210.32 g/mol
Exact Mass210.16
IUPAC Name2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol
SMILESOC(CC1CC2CCC1C2)C1CCCO1
InChIInChI=1S/C13H22O2/c14-12(13-2-1-5-15-13)8-11-7-9-3-4-10(11)6-9/h9-14H,1-8H2
InChIKeySIWVYZMSHFOWKA-UHFFFAOYSA-N
XLogP2.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol with MolForge

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Related Compounds

2-(2-bicyclo[2.2.1]heptanyl)-1-cyclopropylethanol
CID 79557935
2-(2-bicyclo[2.2.1]heptanyl)-1-(6-bicyclo[3.1.0]hexanyl)ethanol
CID 115821223
2-(2-bicyclo[2.2.1]heptanyl)-1-(5-methyloxolan-3-yl)ethanol
CID 115821257
2-(2-bicyclo[2.2.1]heptanyl)-1-(1,1-dioxothiolan-3-yl)ethanol
CID 113289694
(1S)-1-(oxolan-2-yl)propan-1-ol
CID 67355523
(1R)-1-[(2S)-oxolan-2-yl]propan-1-ol
CID 67355521
1-(oxolan-2-yl)propane-1,3-diol
CID 119055061
2-(2-bicyclo[2.2.1]heptanyl)-1-(oxan-3-yl)ethanamine
CID 79562690
[1-(2-bicyclo[2.2.1]heptanyl)-3-(oxan-2-yl)propan-2-yl]hydrazine
CID 105267587
1-(2-bicyclo[2.2.1]heptanyl)-3-(dimethylamino)-3-methylbutan-2-ol
CID 79558432
1-(oxolan-2-yl)pent-4-en-1-ol
CID 10511102
1-(oxolan-2-yl)-2-propan-2-yloxyethanol
CID 79567883

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol (CID 79558980) is 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol is OC(CC1CC2CCC1C2)C1CCCO1.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol?
The InChIKey is SIWVYZMSHFOWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O2/c14-12(13-2-1-5-15-13)8-11-7-9-3-4-10(11)6-9/h9-14H,1-8H2.
What are the key properties of 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol?
2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol has a molecular weight of 210.32 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]heptanyl)-1-(oxolan-2-yl)ethanol is sourced from PubChem (CID 79558980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).