(8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)

C9H16NORb — CID 176714593

IUPAC(8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)
SMILESCOC[C@@]12C[CH-]CN1CCC2.[Rb+]
InChIInChI=1S/C9H16NO.Rb/c1-11-8-9-4-2-6-10(9)7-3-5-9;/h2H,3-8H2,1H3;/q-1;+1/t9-;/m0./s1
InChIKeyJJRBDRQAGDFLOZ-FVGYRXGTSA-N
MW239.70 g/mol
LogP-1.92
Rot. Bonds2

About (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)

(8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+) (PubChem CID 176714593) has the molecular formula C9H16NORb and a molecular weight of 239.70 g/mol. Its IUPAC name is (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+).

Molecular Properties

Compound Name(8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)
PubChem CID176714593
Molecular FormulaC9H16NORb
Molecular Weight239.70 g/mol
Exact Mass239.03
IUPAC Name(8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)
SMILESCOC[C@@]12C[CH-]CN1CCC2.[Rb+]
InChIInChI=1S/C9H16NO.Rb/c1-11-8-9-4-2-6-10(9)7-3-5-9;/h2H,3-8H2,1H3;/q-1;+1/t9-;/m0./s1
InChIKeyJJRBDRQAGDFLOZ-FVGYRXGTSA-N
XLogP-1.92
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.70
LogP ≤ 5-1.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

ethane;8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 168942817
8a-(methoxymethyl)-2,3,5,6,7,8-hexahydro-1H-indolizine;ethane
CID 164878560
8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine;methyl formate
CID 171786358
ethane;[2-fluoro-8-(methoxymethyl)-3,5,6,7-tetrahydro-1H-pyrrolizin-2-yl]phosphane
CID 168881236
(2R,8R)-2-fluoro-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 164903949
(2S,8R)-2-fluoro-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 164878427
ethane;(2R,8S)-2-fluoro-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 177010029
ethane;(2R,8R)-2-methoxy-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 164904163
ethane;8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine;methyl N-methylcarbamate
CID 166533544
8a-(methoxymethyl)-2-methylsulfonyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine
CID 164922505
(5R,7R)-5-(methoxymethyl)-7-methyl-1-azabicyclo[3.2.0]heptane
CID 168881491
ethane;8-(methoxymethyl)-2-methylsulfinyl-1,2,3,5,6,7-hexahydropyrrolizine
CID 164922697

Frequently Asked Questions

What is the IUPAC name of (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)?
The IUPAC name of (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+) (CID 176714593) is (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+).
What is the SMILES notation for (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)?
The canonical SMILES for (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+) is COC[C@@]12C[CH-]CN1CCC2.[Rb+].
What is the InChIKey of (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)?
The InChIKey is JJRBDRQAGDFLOZ-FVGYRXGTSA-N. The full InChI is InChI=1S/C9H16NO.Rb/c1-11-8-9-4-2-6-10(9)7-3-5-9;/h2H,3-8H2,1H3;/q-1;+1/t9-;/m0./s1.
What are the key properties of (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+)?
(8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+) has a molecular weight of 239.70 g/mol, XLogP of -1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-6-ide;rubidium(1+) is sourced from PubChem (CID 176714593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).