2-azaspiro[4.4]nonane-2-sulfonyl chloride

C8H14ClNO2S — CID 130516395

IUPAC2-azaspiro[4.4]nonane-2-sulfonyl chloride
SMILESO=S(=O)(Cl)N1CCC2(CCCC2)C1
InChIInChI=1S/C8H14ClNO2S/c9-13(11,12)10-6-5-8(7-10)3-1-2-4-8/h1-7H2
InChIKeyGAODVKOXLMTXKV-UHFFFAOYSA-N
MW223.72 g/mol
LogP1.74
Rot. Bonds1

About 2-azaspiro[4.4]nonane-2-sulfonyl chloride

2-azaspiro[4.4]nonane-2-sulfonyl chloride (PubChem CID 130516395) has the molecular formula C8H14ClNO2S and a molecular weight of 223.72 g/mol. Its IUPAC name is 2-azaspiro[4.4]nonane-2-sulfonyl chloride.

Molecular Properties

Compound Name2-azaspiro[4.4]nonane-2-sulfonyl chloride
PubChem CID130516395
Molecular FormulaC8H14ClNO2S
Molecular Weight223.72 g/mol
Exact Mass223.04
IUPAC Name2-azaspiro[4.4]nonane-2-sulfonyl chloride
SMILESO=S(=O)(Cl)N1CCC2(CCCC2)C1
InChIInChI=1S/C8H14ClNO2S/c9-13(11,12)10-6-5-8(7-10)3-1-2-4-8/h1-7H2
InChIKeyGAODVKOXLMTXKV-UHFFFAOYSA-N
XLogP1.74
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.72
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.4]nonane-2-sulfonyl chloride?
The IUPAC name of 2-azaspiro[4.4]nonane-2-sulfonyl chloride (CID 130516395) is 2-azaspiro[4.4]nonane-2-sulfonyl chloride.
What is the SMILES notation for 2-azaspiro[4.4]nonane-2-sulfonyl chloride?
The canonical SMILES for 2-azaspiro[4.4]nonane-2-sulfonyl chloride is O=S(=O)(Cl)N1CCC2(CCCC2)C1.
What is the InChIKey of 2-azaspiro[4.4]nonane-2-sulfonyl chloride?
The InChIKey is GAODVKOXLMTXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14ClNO2S/c9-13(11,12)10-6-5-8(7-10)3-1-2-4-8/h1-7H2.
What are the key properties of 2-azaspiro[4.4]nonane-2-sulfonyl chloride?
2-azaspiro[4.4]nonane-2-sulfonyl chloride has a molecular weight of 223.72 g/mol, XLogP of 1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[4.4]nonane-2-sulfonyl chloride is sourced from PubChem (CID 130516395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).