[8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol

C12H22O2 — CID 66848084

IUPAC[8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol
SMILESOCC1CCC2CC(CO)C(CC1)C2
InChIInChI=1S/C12H22O2/c13-7-9-1-2-10-5-11(4-3-9)12(6-10)8-14/h9-14H,1-8H2
InChIKeyKIZACMXWMDDVCB-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.80
Rot. Bonds2

About [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol

[8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol (PubChem CID 66848084) has the molecular formula C12H22O2 and a molecular weight of 198.31 g/mol. Its IUPAC name is [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol.

Molecular Properties

Compound Name[8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol
PubChem CID66848084
Molecular FormulaC12H22O2
Molecular Weight198.31 g/mol
Exact Mass198.16
IUPAC Name[8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol
SMILESOCC1CCC2CC(CO)C(CC1)C2
InChIInChI=1S/C12H22O2/c13-7-9-1-2-10-5-11(4-3-9)12(6-10)8-14/h9-14H,1-8H2
InChIKeyKIZACMXWMDDVCB-UHFFFAOYSA-N
XLogP1.80
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S,5R,6R)-6-bicyclo[3.2.1]octanyl]methanol
CID 131199969
[(1R,2S,5R)-2-bicyclo[3.2.1]octanyl]methanol
CID 130763821
[(1R,2R,4R,5R)-5-(hydroxymethyl)-2-bicyclo[2.2.2]octanyl]methanol
CID 130977937
[(1S,7R)-4-bicyclo[5.1.0]octanyl]methanol
CID 130624155
2-[(1S,4R)-2-bicyclo[2.2.1]heptanyl]ethanol
CID 14043124
(1S,2S,4R)-2-[2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]bicyclo[2.2.1]heptane
CID 54589598
[2-[(2-bicyclo[2.2.1]heptanylmethylamino)methyl]cyclohexyl]methanol
CID 79551480
2-(2-bicyclo[2.2.1]heptanyl)-1,1-difluoroethanethiol
CID 88533788
(1R,2S,4R)-2-(iodomethyl)bicyclo[2.2.1]heptane
CID 98085317
2-(2-bicyclo[2.2.1]heptanylmethyl)-2-ethylbutan-1-ol
CID 79549926
N-[2-(2-bicyclo[2.2.1]heptanyl)ethyl]-4-(hydroxymethyl)piperidine-1-carboxamide
CID 110896638
2-(2-bicyclo[2.2.1]heptanylmethyl)-2-methylbutan-1-ol
CID 79550101

Frequently Asked Questions

What is the IUPAC name of [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol?
The IUPAC name of [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol (CID 66848084) is [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol.
What is the SMILES notation for [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol?
The canonical SMILES for [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol is OCC1CCC2CC(CO)C(CC1)C2.
What is the InChIKey of [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol?
The InChIKey is KIZACMXWMDDVCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O2/c13-7-9-1-2-10-5-11(4-3-9)12(6-10)8-14/h9-14H,1-8H2.
What are the key properties of [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol?
[8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol has a molecular weight of 198.31 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol is sourced from PubChem (CID 66848084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).