2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane

C11H16N2O2S2 — CID 82038199

IUPAC2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane
SMILESO=S(=O)(c1cccs1)N1CCC2(CCNC2)C1
InChIInChI=1S/C11H16N2O2S2/c14-17(15,10-2-1-7-16-10)13-6-4-11(9-13)3-5-12-8-11/h1-2,7,12H,3-6,8-9H2
InChIKeyXGZGZTYKXFSCEV-UHFFFAOYSA-N
MW272.39 g/mol
LogP1.12
Rot. Bonds2

About 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane

2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane (PubChem CID 82038199) has the molecular formula C11H16N2O2S2 and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane.

Molecular Properties

Compound Name2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane
PubChem CID82038199
Molecular FormulaC11H16N2O2S2
Molecular Weight272.39 g/mol
Exact Mass272.07
IUPAC Name2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane
SMILESO=S(=O)(c1cccs1)N1CCC2(CCNC2)C1
InChIInChI=1S/C11H16N2O2S2/c14-17(15,10-2-1-7-16-10)13-6-4-11(9-13)3-5-12-8-11/h1-2,7,12H,3-6,8-9H2
InChIKeyXGZGZTYKXFSCEV-UHFFFAOYSA-N
XLogP1.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(benzenesulfonyl)-2,7-diazaspiro[4.4]nonane
CID 82038202
1-thiophen-2-ylsulfonylpiperazine
CID 3865892
9-pyrimidin-2-yl-2-thiophen-2-ylsulfonyl-2,9-diazaspiro[4.5]decane
CID 131655186
(5S)-2-methyl-10-thiophen-2-ylsulfonyl-7-oxa-2,10-diazaspiro[4.6]undecane
CID 97471956
4-thiophen-2-ylsulfonylthiomorpholine
CID 128941068
1-thiophen-2-ylsulfonylpiperidine
CID 765823
2-(5-methylthiophen-2-yl)sulfonyl-2,8-diazaspiro[5.5]undecane
CID 102850015
7-(2,3-dichlorophenyl)sulfonyl-2,7-diazaspiro[4.5]decane
CID 56747043
2-(2-thiophen-2-ylethyl)-2,7-diazaspiro[4.4]nonane
CID 82038614
3-methyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxylic acid
CID 63135547
4-phenyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxylic acid
CID 2564272
1-thiophen-2-ylsulfonylpiperazin-4-ium
CID 7016013

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane?
The IUPAC name of 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane (CID 82038199) is 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane.
What is the SMILES notation for 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane?
The canonical SMILES for 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane is O=S(=O)(c1cccs1)N1CCC2(CCNC2)C1.
What is the InChIKey of 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane?
The InChIKey is XGZGZTYKXFSCEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S2/c14-17(15,10-2-1-7-16-10)13-6-4-11(9-13)3-5-12-8-11/h1-2,7,12H,3-6,8-9H2.
What are the key properties of 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane?
2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane has a molecular weight of 272.39 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-ylsulfonyl-2,7-diazaspiro[4.4]nonane is sourced from PubChem (CID 82038199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).