(2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol

C8H15NO2 — CID 10820830

IUPAC(2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol
SMILESO[C@@H]1C[C@@H]2[C@@H](O)CCCN2C1
InChIInChI=1S/C8H15NO2/c10-6-4-7-8(11)2-1-3-9(7)5-6/h6-8,10-11H,1-5H2/t6-,7-,8+/m1/s1
InChIKeyHIIULVRVDILYIC-PRJMDXOYSA-N
MW157.21 g/mol
LogP-0.42
Rot. Bonds

About (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol

(2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol (PubChem CID 10820830) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol.

Molecular Properties

Compound Name(2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol
PubChem CID10820830
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name(2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol
SMILESO[C@@H]1C[C@@H]2[C@@H](O)CCCN2C1
InChIInChI=1S/C8H15NO2/c10-6-4-7-8(11)2-1-3-9(7)5-6/h6-8,10-11H,1-5H2/t6-,7-,8+/m1/s1
InChIKeyHIIULVRVDILYIC-PRJMDXOYSA-N
XLogP-0.42
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol with MolForge

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Related Compounds

2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)cyclopentan-1-ol
CID 63151120
(1R,6R,7S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7-triol
CID 11148002
(6R)-6-pyrrolidin-1-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol
CID 143932220
2-(3-hydroxypiperidin-1-yl)cyclobutane-1-carboxylic acid
CID 80996172
cis-(1S,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 23656399
trans-(1R,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 10103566
cis-(1S,2R)-2-pyrrolidin-1-ylcyclopentan-1-ol
CID 93317277
(6R,7S,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-6,7,8-triol
CID 11401041
2-[3-(methylaminomethyl)piperidin-1-yl]cyclopentan-1-ol
CID 61203694
1-(2-hydroxycyclopentyl)piperidine-3-carboxamide
CID 60712103
trans-(1S,2S)-2-(3,4-dimethylpiperidin-1-yl)cyclohexan-1-ol
CID 102732321
2-(3-methoxypiperidin-1-yl)-4-methylcyclohexan-1-ol
CID 102966101

Frequently Asked Questions

What is the IUPAC name of (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol?
The IUPAC name of (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol (CID 10820830) is (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol.
What is the SMILES notation for (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol?
The canonical SMILES for (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol is O[C@@H]1C[C@@H]2[C@@H](O)CCCN2C1.
What is the InChIKey of (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol?
The InChIKey is HIIULVRVDILYIC-PRJMDXOYSA-N. The full InChI is InChI=1S/C8H15NO2/c10-6-4-7-8(11)2-1-3-9(7)5-6/h6-8,10-11H,1-5H2/t6-,7-,8+/m1/s1.
What are the key properties of (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol?
(2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol has a molecular weight of 157.21 g/mol, XLogP of -0.42, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2,8-diol is sourced from PubChem (CID 10820830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).