ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane

C9H21N3O2S — CID 163275222

IUPACethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane
SMILESCC.CN(C1CC2(CNC2)C1)S(N)(=O)=O
InChIInChI=1S/C7H15N3O2S.C2H6/c1-10(13(8,11)12)6-2-7(3-6)4-9-5-7;1-2/h6,9H,2-5H2,1H3,(H2,8,11,12);1-2H3
InChIKeyUGCGQUPTTRQILD-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.10
Rot. Bonds2

About ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane

ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane (PubChem CID 163275222) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Nameethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane
PubChem CID163275222
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC Nameethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane
SMILESCC.CN(C1CC2(CNC2)C1)S(N)(=O)=O
InChIInChI=1S/C7H15N3O2S.C2H6/c1-10(13(8,11)12)6-2-7(3-6)4-9-5-7;1-2/h6,9H,2-5H2,1H3,(H2,8,11,12);1-2H3
InChIKeyUGCGQUPTTRQILD-UHFFFAOYSA-N
XLogP-0.10
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane?
The IUPAC name of ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane (CID 163275222) is ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane.
What is the SMILES notation for ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane?
The canonical SMILES for ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane is CC.CN(C1CC2(CNC2)C1)S(N)(=O)=O.
What is the InChIKey of ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane?
The InChIKey is UGCGQUPTTRQILD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O2S.C2H6/c1-10(13(8,11)12)6-2-7(3-6)4-9-5-7;1-2/h6,9H,2-5H2,1H3,(H2,8,11,12);1-2H3.
What are the key properties of ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane?
ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane has a molecular weight of 235.35 g/mol, XLogP of -0.10, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-[methyl(sulfamoyl)amino]-2-azaspiro[3.3]heptane is sourced from PubChem (CID 163275222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).