2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide

C15H23N3O2S — CID 136518555

IUPAC2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide
SMILESNS(=O)(=O)N1CCC2(CCN(Cc3ccccc3)C2)CC1
InChIInChI=1S/C15H23N3O2S/c16-21(19,20)18-10-7-15(8-11-18)6-9-17(13-15)12-14-4-2-1-3-5-14/h1-5H,6-13H2,(H2,16,19,20)
InChIKeyKHSBMEAXEGOFDB-UHFFFAOYSA-N
MW309.43 g/mol
LogP1.18
Rot. Bonds3

About 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide

2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide (PubChem CID 136518555) has the molecular formula C15H23N3O2S and a molecular weight of 309.43 g/mol. Its IUPAC name is 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide.

Molecular Properties

Compound Name2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide
PubChem CID136518555
Molecular FormulaC15H23N3O2S
Molecular Weight309.43 g/mol
Exact Mass309.15
IUPAC Name2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide
SMILESNS(=O)(=O)N1CCC2(CCN(Cc3ccccc3)C2)CC1
InChIInChI=1S/C15H23N3O2S/c16-21(19,20)18-10-7-15(8-11-18)6-9-17(13-15)12-14-4-2-1-3-5-14/h1-5H,6-13H2,(H2,16,19,20)
InChIKeyKHSBMEAXEGOFDB-UHFFFAOYSA-N
XLogP1.18
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.43
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5S)-2-benzyl-7-methylsulfonyl-2,7-diazaspiro[4.5]decane
CID 3233118
3-amino-1-(2-benzyl-2,8-diazaspiro[4.5]decan-8-yl)butan-1-one
CID 120873764
2-benzyl-7-methyl-2,7-diazaspiro[4.4]nonane
CID 2868838
2-benzyl-8-(chloromethyl)-2-azaspiro[4.5]decane
CID 71646570
3-amino-1-(2-benzyl-2,8-diazaspiro[4.5]decan-8-yl)butan-1-one;hydrochloride
CID 120873763
4-[(7-benzyl-2,7-diazaspiro[4.4]nonan-2-yl)sulfonyl]-5-methyl-1,2-oxazol-3-amine
CID 154745649
(5S,8R)-2-benzyl-2-azaspiro[4.4]nonan-8-amine
CID 98089072
(5R)-2-benzyl-2,7-diazaspiro[4.4]nonane
CID 34178522
2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine
CID 142253116
6-benzyl-2-(bromomethyl)-6-azaspiro[3.4]octane
CID 71650612
1-benzyl-3-(trifluoromethyl)pyrrolidin-3-amine
CID 53403180
7-(benzenesulfonyl)-2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.4]octane
CID 97472438

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide?
The IUPAC name of 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide (CID 136518555) is 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide.
What is the SMILES notation for 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide?
The canonical SMILES for 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide is NS(=O)(=O)N1CCC2(CCN(Cc3ccccc3)C2)CC1.
What is the InChIKey of 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide?
The InChIKey is KHSBMEAXEGOFDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2S/c16-21(19,20)18-10-7-15(8-11-18)6-9-17(13-15)12-14-4-2-1-3-5-14/h1-5H,6-13H2,(H2,16,19,20).
What are the key properties of 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide?
2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide has a molecular weight of 309.43 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-2,8-diazaspiro[4.5]decane-8-sulfonamide is sourced from PubChem (CID 136518555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).