N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide

C10H20N2O2S2 — CID 114628071

IUPACN-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide
SMILESCS(=O)CCNC(=O)CSC1CCNCC1
InChIInChI=1S/C10H20N2O2S2/c1-16(14)7-6-12-10(13)8-15-9-2-4-11-5-3-9/h9,11H,2-8H2,1H3,(H,12,13)
InChIKeyHNIUHAJUCMYQKZ-UHFFFAOYSA-N
MW264.42 g/mol
LogP-0.03
Rot. Bonds6

About N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide

N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide (PubChem CID 114628071) has the molecular formula C10H20N2O2S2 and a molecular weight of 264.42 g/mol. Its IUPAC name is N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide
PubChem CID114628071
Molecular FormulaC10H20N2O2S2
Molecular Weight264.42 g/mol
Exact Mass264.10
IUPAC NameN-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide
SMILESCS(=O)CCNC(=O)CSC1CCNCC1
InChIInChI=1S/C10H20N2O2S2/c1-16(14)7-6-12-10(13)8-15-9-2-4-11-5-3-9/h9,11H,2-8H2,1H3,(H,12,13)
InChIKeyHNIUHAJUCMYQKZ-UHFFFAOYSA-N
XLogP-0.03
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-hydroxyhexyl)-2-piperidin-4-ylsulfanylacetamide
CID 107842483
5-[(2-piperidin-4-ylsulfanylacetyl)amino]pentanamide
CID 106235677
N-[3-(methanesulfonamido)propyl]-2-piperidin-4-ylsulfanylacetamide
CID 106336452
N-(2-ethylbutyl)-2-piperidin-4-ylsulfanylacetamide
CID 114628110
N-(5-hydroxy-4-methylpentyl)-2-piperidin-4-ylsulfanylacetamide
CID 106161364
N-hydroxy-2-piperidin-4-ylsulfanylacetamide
CID 114627599
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-2-piperidin-4-ylsulfanylacetamide
CID 114627230
2-piperidin-4-ylsulfanyl-N-(2-prop-2-ynylsulfanylethyl)acetamide
CID 114187551
2-(azetidin-3-yl)-N-(2-methylsulfinylethyl)acetamide
CID 115739196
N-tert-butyl-2-[(2-piperidin-4-ylsulfanylacetyl)amino]acetamide
CID 114626598
N-[(1-methylpiperidin-4-yl)methyl]-2-piperidin-4-ylsulfanylacetamide
CID 114627369
N-(2,3-dihydroxypropyl)-2-piperidin-4-ylsulfanylacetamide
CID 114627744

Frequently Asked Questions

What is the IUPAC name of N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide?
The IUPAC name of N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide (CID 114628071) is N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide.
What is the SMILES notation for N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide?
The canonical SMILES for N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide is CS(=O)CCNC(=O)CSC1CCNCC1.
What is the InChIKey of N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide?
The InChIKey is HNIUHAJUCMYQKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S2/c1-16(14)7-6-12-10(13)8-15-9-2-4-11-5-3-9/h9,11H,2-8H2,1H3,(H,12,13).
What are the key properties of N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide?
N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide has a molecular weight of 264.42 g/mol, XLogP of -0.03, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylsulfinylethyl)-2-piperidin-4-ylsulfanylacetamide is sourced from PubChem (CID 114628071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).