2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid

C10H18N2O4S — CID 61358768

IUPAC2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid
SMILESO=C(O)CS(=O)(=O)NC1CCNC2(CCC2)C1
InChIInChI=1S/C10H18N2O4S/c13-9(14)7-17(15,16)12-8-2-5-11-10(6-8)3-1-4-10/h8,11-12H,1-7H2,(H,13,14)
InChIKeyCDKLHKAGUGGLHO-UHFFFAOYSA-N
MW262.33 g/mol
LogP-0.33
Rot. Bonds4

About 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid

2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid (PubChem CID 61358768) has the molecular formula C10H18N2O4S and a molecular weight of 262.33 g/mol. Its IUPAC name is 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid.

Molecular Properties

Compound Name2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid
PubChem CID61358768
Molecular FormulaC10H18N2O4S
Molecular Weight262.33 g/mol
Exact Mass262.10
IUPAC Name2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid
SMILESO=C(O)CS(=O)(=O)NC1CCNC2(CCC2)C1
InChIInChI=1S/C10H18N2O4S/c13-9(14)7-17(15,16)12-8-2-5-11-10(6-8)3-1-4-10/h8,11-12H,1-7H2,(H,13,14)
InChIKeyCDKLHKAGUGGLHO-UHFFFAOYSA-N
XLogP-0.33
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-Azaspiro[3.5]nonan-8-ylsulfamoyl)propanoic acid
CID 54947607
2-(1-Azaspiro[5.5]undecan-4-ylsulfamoyl)acetic acid
CID 61358770
2-(3-Pyrrolidin-2-ylpiperidin-1-yl)sulfonylacetic acid
CID 61359353
Methyl 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetate
CID 61360128
Methyl 2-(1-azaspiro[5.5]undecan-4-ylsulfamoyl)acetate
CID 61360322
4-(3-Pyrrolidin-2-ylpiperidin-1-yl)sulfonylbutanoic acid
CID 61457419
Ethyl 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetate
CID 61457573
Ethyl 2-(1-azaspiro[5.5]undecan-4-ylsulfamoyl)acetate
CID 61457574
Methyl 4-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)butanoate
CID 61457633
4-(5-Azaspiro[3.5]nonan-8-ylsulfamoyl)butanoic acid
CID 61457673
4-(1-Azaspiro[5.5]undecan-4-ylsulfamoyl)butanoic acid
CID 61457713
2-(1-Azaspiro[5.5]undecan-4-ylsulfamoyl)propanoic acid
CID 61457776

Frequently Asked Questions

What is the IUPAC name of 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid?
The IUPAC name of 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid (CID 61358768) is 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid.
What is the SMILES notation for 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid?
The canonical SMILES for 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid is O=C(O)CS(=O)(=O)NC1CCNC2(CCC2)C1.
What is the InChIKey of 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid?
The InChIKey is CDKLHKAGUGGLHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4S/c13-9(14)7-17(15,16)12-8-2-5-11-10(6-8)3-1-4-10/h8,11-12H,1-7H2,(H,13,14).
What are the key properties of 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid?
2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid has a molecular weight of 262.33 g/mol, XLogP of -0.33, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-azaspiro[3.5]nonan-8-ylsulfamoyl)acetic acid is sourced from PubChem (CID 61358768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).