(6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one

C10H15NO2 — CID 23244200

IUPAC(6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one
SMILESO=C1OCC[C@]12C[C@@H]1CCCN1C2
InChIInChI=1S/C10H15NO2/c12-9-10(3-5-13-9)6-8-2-1-4-11(8)7-10/h8H,1-7H2/t8-,10+/m0/s1
InChIKeySLOWXVBJJVLAJZ-WCBMZHEXSA-N
MW181.23 g/mol
LogP0.79
Rot. Bonds

About (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one

(6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one (PubChem CID 23244200) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one.

Molecular Properties

Compound Name(6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one
PubChem CID23244200
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name(6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one
SMILESO=C1OCC[C@]12C[C@@H]1CCCN1C2
InChIInChI=1S/C10H15NO2/c12-9-10(3-5-13-9)6-8-2-1-4-11(8)7-10/h8H,1-7H2/t8-,10+/m0/s1
InChIKeySLOWXVBJJVLAJZ-WCBMZHEXSA-N
XLogP0.79
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Ethyl hexahydrospiro[cyclopentane-1,3'-pyrrolizine]-1'-carboxylate
CID 4913249
ethyl (1R,8S)-spiro[1,2,5,6,7,8-hexahydropyrrolizine-3,1'-cyclopentane]-1-carboxylate
CID 7201284
ethyl (1S,8S)-spiro[1,2,5,6,7,8-hexahydropyrrolizine-3,1'-cyclopentane]-1-carboxylate
CID 7201286
ethyl (1R,8R)-spiro[1,2,5,6,7,8-hexahydropyrrolizine-3,1'-cyclopentane]-1-carboxylate
CID 11889823
ethyl (1S,8R)-spiro[1,2,5,6,7,8-hexahydropyrrolizine-3,1'-cyclopentane]-1-carboxylate
CID 11889825
Spiro[1,2,3,5,6,8-hexahydropyrrolizine-7,3'-oxolane]-2',5'-dione
CID 82855479
(6R,8R)-7-methylidenespiro[2,3,5,8-tetrahydro-1H-pyrrolizine-6,3'-oxolane]-2'-one
CID 101119695
(6S,7R,8S)-7-(2-trimethylsilylethynyl)spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one
CID 101119730
(6R,7S,8R)-7-(2-trimethylsilylethynyl)spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one
CID 101119731
(6S,7R,8R)-7-(2-trimethylsilylethynyl)spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one
CID 101119732
(6R,7S,8S)-7-(2-trimethylsilylethynyl)spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one
CID 101119733
(6R,7R,8R)-7-(2-trimethylsilylethynyl)spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one
CID 101119738

Frequently Asked Questions

What is the IUPAC name of (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one?
The IUPAC name of (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one (CID 23244200) is (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one.
What is the SMILES notation for (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one?
The canonical SMILES for (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one is O=C1OCC[C@]12C[C@@H]1CCCN1C2.
What is the InChIKey of (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one?
The InChIKey is SLOWXVBJJVLAJZ-WCBMZHEXSA-N. The full InChI is InChI=1S/C10H15NO2/c12-9-10(3-5-13-9)6-8-2-1-4-11(8)7-10/h8H,1-7H2/t8-,10+/m0/s1.
What are the key properties of (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one?
(6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one has a molecular weight of 181.23 g/mol, XLogP of 0.79, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S,8S)-spiro[1,2,3,5,7,8-hexahydropyrrolizine-6,3'-oxolane]-2'-one is sourced from PubChem (CID 23244200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).