N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide

C12H24N2OS — CID 78785728

IUPACN-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide
SMILESCSCC(=O)NCC(C)(C)N1CCCCC1
InChIInChI=1S/C12H24N2OS/c1-12(2,10-13-11(15)9-16-3)14-7-5-4-6-8-14/h4-10H2,1-3H3,(H,13,15)
InChIKeyMTENXENZLLFYIB-UHFFFAOYSA-N
MW244.40 g/mol
LogP1.73
Rot. Bonds5

About N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide

N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide (PubChem CID 78785728) has the molecular formula C12H24N2OS and a molecular weight of 244.40 g/mol. Its IUPAC name is N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide.

Molecular Properties

Compound NameN-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide
PubChem CID78785728
Molecular FormulaC12H24N2OS
Molecular Weight244.40 g/mol
Exact Mass244.16
IUPAC NameN-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide
SMILESCSCC(=O)NCC(C)(C)N1CCCCC1
InChIInChI=1S/C12H24N2OS/c1-12(2,10-13-11(15)9-16-3)14-7-5-4-6-8-14/h4-10H2,1-3H3,(H,13,15)
InChIKeyMTENXENZLLFYIB-UHFFFAOYSA-N
XLogP1.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.40
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluorophenyl)sulfanyl-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide
CID 51164309
N-(2-hydroxy-2-methylpropyl)-2-methylsulfanylacetamide
CID 65109943
1-(2-hydroxy-2,3-dimethylbutyl)-3-(2-methyl-2-piperidin-1-ylpropyl)urea
CID 111120835
4-(4-methylphenyl)-N-(2-methyl-2-piperidin-1-ylpropyl)-4-oxobutanamide
CID 51164342
2,2-dichloro-1-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)cyclopropane-1-carboxamide
CID 78785737
2-hydroxy-2-methyl-3-[(2-methylsulfanylacetyl)amino]propanoic acid
CID 66171975
3-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)propanamide
CID 110622499
1-[[1-(hydroxymethyl)cyclopropyl]methyl]-3-(2-methyl-2-piperidin-1-ylpropyl)urea
CID 111618380
1-(4-hydroxy-3-methylbutan-2-yl)-3-(2-methyl-2-piperidin-1-ylpropyl)urea
CID 111453991
2-(3-methoxyphenyl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide
CID 51164393
N-(2-methyl-2-piperidin-1-ylpropyl)-4-oxo-4-thiophen-2-ylbutanamide
CID 51164347
N-(2-methyl-2-piperidin-1-ylpropyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 51164336

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide?
The IUPAC name of N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide (CID 78785728) is N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide.
What is the SMILES notation for N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide?
The canonical SMILES for N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide is CSCC(=O)NCC(C)(C)N1CCCCC1.
What is the InChIKey of N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide?
The InChIKey is MTENXENZLLFYIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2OS/c1-12(2,10-13-11(15)9-16-3)14-7-5-4-6-8-14/h4-10H2,1-3H3,(H,13,15).
What are the key properties of N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide?
N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide has a molecular weight of 244.40 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-piperidin-1-ylpropyl)-2-methylsulfanylacetamide is sourced from PubChem (CID 78785728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).