(5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide

C8H16N2O2S — CID 70171578

IUPAC(5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide
SMILESC[C@H]1C[C@]2(CCN1)CCS(=O)(=O)N2
InChIInChI=1S/C8H16N2O2S/c1-7-6-8(2-4-9-7)3-5-13(11,12)10-8/h7,9-10H,2-6H2,1H3/t7-,8-/m0/s1
InChIKeyFYZHOUPBCIXJFD-YUMQZZPRSA-N
MW204.29 g/mol
LogP-0.18
Rot. Bonds

About (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide

(5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide (PubChem CID 70171578) has the molecular formula C8H16N2O2S and a molecular weight of 204.29 g/mol. Its IUPAC name is (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide.

Molecular Properties

Compound Name(5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide
PubChem CID70171578
Molecular FormulaC8H16N2O2S
Molecular Weight204.29 g/mol
Exact Mass204.09
IUPAC Name(5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide
SMILESC[C@H]1C[C@]2(CCN1)CCS(=O)(=O)N2
InChIInChI=1S/C8H16N2O2S/c1-7-6-8(2-4-9-7)3-5-13(11,12)10-8/h7,9-10H,2-6H2,1H3/t7-,8-/m0/s1
InChIKeyFYZHOUPBCIXJFD-YUMQZZPRSA-N
XLogP-0.18
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide?
The IUPAC name of (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide (CID 70171578) is (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide.
What is the SMILES notation for (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide?
The canonical SMILES for (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide is C[C@H]1C[C@]2(CCN1)CCS(=O)(=O)N2.
What is the InChIKey of (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide?
The InChIKey is FYZHOUPBCIXJFD-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H16N2O2S/c1-7-6-8(2-4-9-7)3-5-13(11,12)10-8/h7,9-10H,2-6H2,1H3/t7-,8-/m0/s1.
What are the key properties of (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide?
(5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide has a molecular weight of 204.29 g/mol, XLogP of -0.18, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,7S)-7-methyl-2λ6-thia-1,8-diazaspiro[4.5]decane 2,2-dioxide is sourced from PubChem (CID 70171578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).