[(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol

C9H16O — CID 131199969

IUPAC[(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol
SMILESOC[C@@H]1C[C@H]2CCC[C@@H]1C2
InChIInChI=1S/C9H16O/c10-6-9-5-7-2-1-3-8(9)4-7/h7-10H,1-6H2/t7-,8+,9-/m0/s1
InChIKeyRKRSPOQMWINIJR-YIZRAAEISA-N
MW140.23 g/mol
LogP1.80
Rot. Bonds1

About [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol

[(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol (PubChem CID 131199969) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol.

Molecular Properties

Compound Name[(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol
PubChem CID131199969
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name[(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol
SMILESOC[C@@H]1C[C@H]2CCC[C@@H]1C2
InChIInChI=1S/C9H16O/c10-6-9-5-7-2-1-3-8(9)4-7/h7-10H,1-6H2/t7-,8+,9-/m0/s1
InChIKeyRKRSPOQMWINIJR-YIZRAAEISA-N
XLogP1.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol with MolForge

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Related Compounds

(2-amino-3-bicyclo[3.3.1]nonanyl)methanol
CID 89331972
[8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol
CID 66848084
[(1R,2R,4R,5R)-5-(hydroxymethyl)-2-bicyclo[2.2.2]octanyl]methanol
CID 130977937
2-[(1S,4R)-2-bicyclo[2.2.1]heptanyl]ethanol
CID 14043124
[(1R,2S,5R)-2-bicyclo[3.2.1]octanyl]methanol
CID 130763821
6-(2-cyclohexylethyl)bicyclo[3.2.1]octane
CID 171097692
[2-[(2-bicyclo[2.2.1]heptanylmethylamino)methyl]cyclohexyl]methanol
CID 79551480
(1S,5R,6R)-bicyclo[3.2.1]octan-6-amine
CID 14638743
3-ethyl-2-methylbicyclo[3.3.1]nonane
CID 148913731
(1R,5R)-2-ethylbicyclo[3.3.1]nonane
CID 143508540
(1S,2S,4R)-2-[2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]bicyclo[2.2.1]heptane
CID 54589598
[(1R,7R,8S)-8-bicyclo[5.2.0]nonanyl]methanol
CID 176573331

Frequently Asked Questions

What is the IUPAC name of [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol?
The IUPAC name of [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol (CID 131199969) is [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol.
What is the SMILES notation for [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol?
The canonical SMILES for [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol is OC[C@@H]1C[C@H]2CCC[C@@H]1C2.
What is the InChIKey of [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol?
The InChIKey is RKRSPOQMWINIJR-YIZRAAEISA-N. The full InChI is InChI=1S/C9H16O/c10-6-9-5-7-2-1-3-8(9)4-7/h7-10H,1-6H2/t7-,8+,9-/m0/s1.
What are the key properties of [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol?
[(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol has a molecular weight of 140.23 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol is sourced from PubChem (CID 131199969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).