8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione

C15H25N3O2S — CID 106326405

IUPAC8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC1C(=O)NC2(CCCC2)C(=O)N1CCN1CCSCC1
InChIInChI=1S/C15H25N3O2S/c1-12-13(19)16-15(4-2-3-5-15)14(20)18(12)7-6-17-8-10-21-11-9-17/h12H,2-11H2,1H3,(H,16,19)
InChIKeyVSQTUOQHIAOGAT-UHFFFAOYSA-N
MW311.45 g/mol
LogP0.69
Rot. Bonds3

About 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione

8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 106326405) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID106326405
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC1C(=O)NC2(CCCC2)C(=O)N1CCN1CCSCC1
InChIInChI=1S/C15H25N3O2S/c1-12-13(19)16-15(4-2-3-5-15)14(20)18(12)7-6-17-8-10-21-11-9-17/h12H,2-11H2,1H3,(H,16,19)
InChIKeyVSQTUOQHIAOGAT-UHFFFAOYSA-N
XLogP0.69
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione with MolForge

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Related Compounds

8-methyl-9-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886681
5-methyl-6-(2-thiomorpholin-4-ylethyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 114173990
8-methyl-9-(3-methylbutyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887057
8-methyl-9-octyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886104
8-methyl-9-[2-(trifluoromethylsulfanyl)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 116627679
8-methyl-9-(2,2,2-trifluoroethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887442
9-hex-5-ynyl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 106210771
9-(3-ethoxypropyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64958654
4-(cyclopropylmethyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64887432
9-(cyclohexylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886872
4-(2,2-dimethylbutyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 103465383
8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 114469832

Frequently Asked Questions

What is the IUPAC name of 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione (CID 106326405) is 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione is CC1C(=O)NC2(CCCC2)C(=O)N1CCN1CCSCC1.
What is the InChIKey of 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is VSQTUOQHIAOGAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-12-13(19)16-15(4-2-3-5-15)14(20)18(12)7-6-17-8-10-21-11-9-17/h12H,2-11H2,1H3,(H,16,19).
What are the key properties of 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 311.45 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 106326405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).