2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane

C10H20N2S — CID 130525850

IUPAC2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane
SMILESCSCCN1CCC2(CCNC2)C1
InChIInChI=1S/C10H20N2S/c1-13-7-6-12-5-3-10(9-12)2-4-11-8-10/h11H,2-9H2,1H3
InChIKeyXFJZLHJPVBSKTB-UHFFFAOYSA-N
MW200.35 g/mol
LogP1.03
Rot. Bonds3

About 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane

2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane (PubChem CID 130525850) has the molecular formula C10H20N2S and a molecular weight of 200.35 g/mol. Its IUPAC name is 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane.

Molecular Properties

Compound Name2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane
PubChem CID130525850
Molecular FormulaC10H20N2S
Molecular Weight200.35 g/mol
Exact Mass200.13
IUPAC Name2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane
SMILESCSCCN1CCC2(CCNC2)C1
InChIInChI=1S/C10H20N2S/c1-13-7-6-12-5-3-10(9-12)2-4-11-8-10/h11H,2-9H2,1H3
InChIKeyXFJZLHJPVBSKTB-UHFFFAOYSA-N
XLogP1.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine
CID 128922534
2-ethyl-2,7-diazaspiro[4.4]nonane chloride
CID 53314750
2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane
CID 82038602
4-(2,7-diazaspiro[4.4]nonan-2-yl)butanenitrile
CID 130525832
2-[(E)-but-2-enyl]-2,7-diazaspiro[4.4]nonane
CID 130525863
2-(2,2-diethylbutyl)-2,7-diazaspiro[4.4]nonane
CID 120907644
2-methyl-2,7-diazaspiro[4.4]nonane;propane
CID 169170198
8-ethyl-2,8-diazaspiro[4.5]decane
CID 46318290
2-(2,9-diazaspiro[4.5]decan-2-yl)ethanamine
CID 130608102
1-(2,7-diazaspiro[4.4]nonan-2-yl)butan-2-ol
CID 130525842
8-butyl-2,8-diazaspiro[4.5]decane
CID 83699136
2-[(1-methylpyrazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120907742

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane?
The IUPAC name of 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane (CID 130525850) is 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane.
What is the SMILES notation for 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane?
The canonical SMILES for 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane is CSCCN1CCC2(CCNC2)C1.
What is the InChIKey of 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane?
The InChIKey is XFJZLHJPVBSKTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2S/c1-13-7-6-12-5-3-10(9-12)2-4-11-8-10/h11H,2-9H2,1H3.
What are the key properties of 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane?
2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane has a molecular weight of 200.35 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane is sourced from PubChem (CID 130525850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).