(1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one

C10H15NO2 — CID 155682575

IUPAC(1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one
SMILESO=C1C[C@@]2(CN1)C[C@H]1CC(O)C[C@H]12
InChIInChI=1S/C10H15NO2/c12-7-1-6-3-10(8(6)2-7)4-9(13)11-5-10/h6-8,12H,1-5H2,(H,11,13)/t6-,7?,8-,10-/m1/s1
InChIKeyPMVMIARZQKUZLT-RIVDWHPASA-N
MW181.23 g/mol
LogP0.28
Rot. Bonds

About (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one

(1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one (PubChem CID 155682575) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one.

Molecular Properties

Compound Name(1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one
PubChem CID155682575
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name(1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one
SMILESO=C1C[C@@]2(CN1)C[C@H]1CC(O)C[C@H]12
InChIInChI=1S/C10H15NO2/c12-7-1-6-3-10(8(6)2-7)4-9(13)11-5-10/h6-8,12H,1-5H2,(H,11,13)/t6-,7?,8-,10-/m1/s1
InChIKeyPMVMIARZQKUZLT-RIVDWHPASA-N
XLogP0.28
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one with MolForge

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Related Compounds

3-hydroxy-6-azaspiro[3.4]octan-7-one
CID 146160573
(1S,5R)-3-ethylspiro[bicyclo[3.2.0]hept-2-ene-7,4'-pyrrolidine]-2'-one
CID 175675558
(1R,5S)-spiro[bicyclo[3.2.0]heptane-3,4'-pyrrolidine]-2'-one
CID 59093997
(5R,9S)-9-methyl-2-azaspiro[4.4]nonan-3-one
CID 97030978
6-fluoro-2-azaspiro[4.5]decan-3-one
CID 160687373
7,9-dimethyl-2-azaspiro[4.5]decan-3-one
CID 66109117
5-hydroxy-3-azaspiro[5.5]undecan-2-one
CID 165468946
7-cyclopropyl-2-azaspiro[4.5]decan-3-one
CID 66109112
3-amino-5-oxopyrrolidine-3-carboxylic acid
CID 162691228
5-hydroxy-4,4-dimethylpiperidin-2-one
CID 136574844
3-(cyclobutylmethyl)-5-oxopyrrolidine-3-carboxylic acid
CID 84720895
5-azaspiro[2.4]heptan-6-one;molecular hydrogen
CID 171823413

Frequently Asked Questions

What is the IUPAC name of (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one?
The IUPAC name of (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one (CID 155682575) is (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one.
What is the SMILES notation for (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one?
The canonical SMILES for (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one is O=C1C[C@@]2(CN1)C[C@H]1CC(O)C[C@H]12.
What is the InChIKey of (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one?
The InChIKey is PMVMIARZQKUZLT-RIVDWHPASA-N. The full InChI is InChI=1S/C10H15NO2/c12-7-1-6-3-10(8(6)2-7)4-9(13)11-5-10/h6-8,12H,1-5H2,(H,11,13)/t6-,7?,8-,10-/m1/s1.
What are the key properties of (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one?
(1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one has a molecular weight of 181.23 g/mol, XLogP of 0.28, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5R,6S)-3-hydroxyspiro[bicyclo[3.2.0]heptane-6,4'-pyrrolidine]-2'-one is sourced from PubChem (CID 155682575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).