2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol

C11H21NO — CID 10631320

IUPAC2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol
SMILESC[C@@H]1CC[C@@H](CCO)N2CCC[C@@H]12
InChIInChI=1S/C11H21NO/c1-9-4-5-10(6-8-13)12-7-2-3-11(9)12/h9-11,13H,2-8H2,1H3/t9-,10+,11+/m1/s1
InChIKeyGJKLCTIPNNPPIM-VWYCJHECSA-N
MW183.29 g/mol
LogP1.63
Rot. Bonds2

About 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol

2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol (PubChem CID 10631320) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol.

Molecular Properties

Compound Name2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol
PubChem CID10631320
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol
SMILESC[C@@H]1CC[C@@H](CCO)N2CCC[C@@H]12
InChIInChI=1S/C11H21NO/c1-9-4-5-10(6-8-13)12-7-2-3-11(9)12/h9-11,13H,2-8H2,1H3/t9-,10+,11+/m1/s1
InChIKeyGJKLCTIPNNPPIM-VWYCJHECSA-N
XLogP1.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol with MolForge

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Related Compounds

(+)-Tashiromine
CID 11019091
(8-Methyl-8-azabicyclo(3.2.1)octan-3-yl)methanol
CID 22056633
(1-methyl-3,5,6,7,8,8a-hexahydro-2H-indolizin-1-yl)methanol
CID 118733448
2-[(5R,6R,8R,8aR)-6-ethyl-5-pentyl-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]ethanol
CID 163022801
(-)-Tashiromine
CID 11051891
3-[(3R,8aR)-3-butyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]propan-1-ol
CID 134827947
3-Methyl-7-hydroxyoctahydroindolizine
CID 129855533
2-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]ethanol
CID 10607223
3-[(3R,5S,8aR)-3-butyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]propan-1-ol
CID 11021001
1,2,3,5,6,7,8,8a-Octahydroindolizin-1-ylmethanol
CID 13967743
2-(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanol
CID 54218768
4-[(5R,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]butan-1-ol
CID 10536480

Frequently Asked Questions

What is the IUPAC name of 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol?
The IUPAC name of 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol (CID 10631320) is 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol.
What is the SMILES notation for 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol?
The canonical SMILES for 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol is C[C@@H]1CC[C@@H](CCO)N2CCC[C@@H]12.
What is the InChIKey of 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol?
The InChIKey is GJKLCTIPNNPPIM-VWYCJHECSA-N. The full InChI is InChI=1S/C11H21NO/c1-9-4-5-10(6-8-13)12-7-2-3-11(9)12/h9-11,13H,2-8H2,1H3/t9-,10+,11+/m1/s1.
What are the key properties of 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol?
2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol has a molecular weight of 183.29 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5S,8R,8aS)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol is sourced from PubChem (CID 10631320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).