6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide

C13H23NO2S — CID 112570757

IUPAC6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide
SMILESO=S1(=O)CCC2(CCNCC2C2CCCC2)C1
InChIInChI=1S/C13H23NO2S/c15-17(16)8-6-13(10-17)5-7-14-9-12(13)11-3-1-2-4-11/h11-12,14H,1-10H2
InChIKeyXEWXRKNZJZHBJQ-UHFFFAOYSA-N
MW257.40 g/mol
LogP1.59
Rot. Bonds1

About 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide

6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide (PubChem CID 112570757) has the molecular formula C13H23NO2S and a molecular weight of 257.40 g/mol. Its IUPAC name is 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide.

Molecular Properties

Compound Name6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide
PubChem CID112570757
Molecular FormulaC13H23NO2S
Molecular Weight257.40 g/mol
Exact Mass257.14
IUPAC Name6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide
SMILESO=S1(=O)CCC2(CCNCC2C2CCCC2)C1
InChIInChI=1S/C13H23NO2S/c15-17(16)8-6-13(10-17)5-7-14-9-12(13)11-3-1-2-4-11/h11-12,14H,1-10H2
InChIKeyXEWXRKNZJZHBJQ-UHFFFAOYSA-N
XLogP1.59
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.40
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopentyl-3-azaspiro[5.6]dodecane
CID 112570787
11-cyclopentyl-3-oxa-9-azaspiro[5.5]undecane
CID 112570802
5-cyclopentyl-9-propan-2-yl-3-azaspiro[5.5]undecane
CID 112570873
9-tert-butyl-5-cyclopentyl-3-azaspiro[5.5]undecane
CID 115927129
2-cyclopentyl-5-azaspiro[2.4]heptane
CID 115013095
11-cyclopentyl-3-ethyl-3,9-diazaspiro[5.5]undecane
CID 112570790
11-propyl-2λ6-thia-9-azaspiro[5.5]undecane 2,2-dioxide
CID 79320236
3-cyclohexyl-4-fluoro-4-methylpiperidine
CID 84721139
3-cycloheptyl-4-fluoro-4-methylpiperidine
CID 84723549
3-cyclopentyl-4-methyl-4-propan-2-ylpiperidine
CID 112570765
3'-cyclopentylspiro[adamantane-2,4'-piperidine]
CID 115927123
3-cyclobutyl-4-fluoro-4-methylpiperidine
CID 84717415

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide?
The IUPAC name of 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide (CID 112570757) is 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide.
What is the SMILES notation for 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide?
The canonical SMILES for 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide is O=S1(=O)CCC2(CCNCC2C2CCCC2)C1.
What is the InChIKey of 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide?
The InChIKey is XEWXRKNZJZHBJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2S/c15-17(16)8-6-13(10-17)5-7-14-9-12(13)11-3-1-2-4-11/h11-12,14H,1-10H2.
What are the key properties of 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide?
6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide has a molecular weight of 257.40 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide is sourced from PubChem (CID 112570757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).