(7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol

C12H21NO3 — CID 15177770

IUPAC(7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol
SMILESO[C@H]1CCC2(C[C@@H]1N1CCCC1)OCCO2
InChIInChI=1S/C12H21NO3/c14-11-3-4-12(15-7-8-16-12)9-10(11)13-5-1-2-6-13/h10-11,14H,1-9H2/t10-,11-/m0/s1
InChIKeyGLOSMYJNRNEYEN-QWRGUYRKSA-N
MW227.30 g/mol
LogP0.74
Rot. Bonds1

About (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol

(7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol (PubChem CID 15177770) has the molecular formula C12H21NO3 and a molecular weight of 227.30 g/mol. Its IUPAC name is (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol.

Molecular Properties

Compound Name(7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol
PubChem CID15177770
Molecular FormulaC12H21NO3
Molecular Weight227.30 g/mol
Exact Mass227.15
IUPAC Name(7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol
SMILESO[C@H]1CCC2(C[C@@H]1N1CCCC1)OCCO2
InChIInChI=1S/C12H21NO3/c14-11-3-4-12(15-7-8-16-12)9-10(11)13-5-1-2-6-13/h10-11,14H,1-9H2/t10-,11-/m0/s1
InChIKeyGLOSMYJNRNEYEN-QWRGUYRKSA-N
XLogP0.74
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.30
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 79931334
7-(3,4-dimethylpyrrolidin-1-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 79183815
7-(4-propylpiperidin-1-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 62204879
7-(3-methoxy-3-methylpiperidin-1-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 107394567
7-(1,3-dihydroisoindol-2-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 62230991
7-[3-(dimethylamino)pyrrolidin-1-yl]-1,4-dioxaspiro[4.5]decan-8-ol
CID 63164876
trans-(1R,2R)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)cyclohexan-1-ol
CID 86594080
trans-(1R,2R)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)cyclopentan-1-ol
CID 126846526
7-amino-1,4-dioxaspiro[4.5]decan-8-ol
CID 76655508
(1S)-2-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)cyclohexan-1-ol
CID 45358553
7-(4-methyl-1,4-diazepan-1-yl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 43211400
2-(4,4-dimethylazepan-1-yl)-4,4-dimethylcyclohexan-1-ol
CID 65282366

Frequently Asked Questions

What is the IUPAC name of (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol?
The IUPAC name of (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol (CID 15177770) is (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol.
What is the SMILES notation for (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol?
The canonical SMILES for (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol is O[C@H]1CCC2(C[C@@H]1N1CCCC1)OCCO2.
What is the InChIKey of (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol?
The InChIKey is GLOSMYJNRNEYEN-QWRGUYRKSA-N. The full InChI is InChI=1S/C12H21NO3/c14-11-3-4-12(15-7-8-16-12)9-10(11)13-5-1-2-6-13/h10-11,14H,1-9H2/t10-,11-/m0/s1.
What are the key properties of (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol?
(7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol has a molecular weight of 227.30 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol is sourced from PubChem (CID 15177770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).