(5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol

C14H25NO2 — CID 69087459

IUPAC(5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol
SMILESC[C@H]1CC[C@@]2(CC(O)CO2)C[C@@H]1N1CCCC1
InChIInChI=1S/C14H25NO2/c1-11-4-5-14(8-12(16)10-17-14)9-13(11)15-6-2-3-7-15/h11-13,16H,2-10H2,1H3/t11-,12?,13-,14+/m0/s1
InChIKeyDLKPCHIINKEFQR-FUDCBSFHSA-N
MW239.36 g/mol
LogP1.79
Rot. Bonds1

About (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol

(5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol (PubChem CID 69087459) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol.

Molecular Properties

Compound Name(5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol
PubChem CID69087459
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name(5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol
SMILESC[C@H]1CC[C@@]2(CC(O)CO2)C[C@@H]1N1CCCC1
InChIInChI=1S/C14H25NO2/c1-11-4-5-14(8-12(16)10-17-14)9-13(11)15-6-2-3-7-15/h11-13,16H,2-10H2,1H3/t11-,12?,13-,14+/m0/s1
InChIKeyDLKPCHIINKEFQR-FUDCBSFHSA-N
XLogP1.79
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-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

1-(8-methyl-1-oxaspiro[4.5]decan-7-yl)pyrrolidine
CID 129087656
(3S)-1-oxaspiro[4.4]nonan-3-ol
CID 124707938
(3S)-3-hydroxy-1-oxa-8-azaspiro[4.5]decane-8-carboxylic acid
CID 68609344
N-[(5S,7S,8S)-3-hydroxy-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]-N-methyl-2-phenylacetamide;N-[(5S,7S,8S)-3-(2-methoxyethoxymethoxy)-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]-N-methyl-2-phenylacetamide;N-methyl-N-[(5R,7S,8S)-3-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]-2-phenylacetamide
CID 158939344
3-methyl-1-oxaspiro[4.5]decan-8-ol
CID 70367589
(7S,8S)-7-pyrrolidin-1-yl-1,4-dioxaspiro[4.5]decan-8-ol
CID 15177770
1-[(2R)-2-methylcyclopentyl]piperidine
CID 59715874
(1R)-1-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
CID 16637720
ethyl (3R)-3-hydroxy-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CID 93487951
ethyl (3S)-3-hydroxy-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CID 93487950
(8aR)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine
CID 155305626
1-(3-pyrrolidin-1-yl-1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone
CID 155879884

Frequently Asked Questions

What is the IUPAC name of (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol?
The IUPAC name of (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol (CID 69087459) is (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol.
What is the SMILES notation for (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol?
The canonical SMILES for (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol is C[C@H]1CC[C@@]2(CC(O)CO2)C[C@@H]1N1CCCC1.
What is the InChIKey of (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol?
The InChIKey is DLKPCHIINKEFQR-FUDCBSFHSA-N. The full InChI is InChI=1S/C14H25NO2/c1-11-4-5-14(8-12(16)10-17-14)9-13(11)15-6-2-3-7-15/h11-13,16H,2-10H2,1H3/t11-,12?,13-,14+/m0/s1.
What are the key properties of (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol?
(5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol has a molecular weight of 239.36 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,7S,8S)-8-methyl-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-3-ol is sourced from PubChem (CID 69087459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).