N-(2-methylsulfanylpropyl)piperidine-1-carboxamide

C10H20N2OS — CID 115760436

IUPACN-(2-methylsulfanylpropyl)piperidine-1-carboxamide
SMILESCSC(C)CNC(=O)N1CCCCC1
InChIInChI=1S/C10H20N2OS/c1-9(14-2)8-11-10(13)12-6-4-3-5-7-12/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyVETCTYMPICGFCP-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.93
Rot. Bonds3

About N-(2-methylsulfanylpropyl)piperidine-1-carboxamide

N-(2-methylsulfanylpropyl)piperidine-1-carboxamide (PubChem CID 115760436) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is N-(2-methylsulfanylpropyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-methylsulfanylpropyl)piperidine-1-carboxamide
PubChem CID115760436
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC NameN-(2-methylsulfanylpropyl)piperidine-1-carboxamide
SMILESCSC(C)CNC(=O)N1CCCCC1
InChIInChI=1S/C10H20N2OS/c1-9(14-2)8-11-10(13)12-6-4-3-5-7-12/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyVETCTYMPICGFCP-UHFFFAOYSA-N
XLogP1.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-(2-methylsulfanylpropylcarbamoyl)piperidine-3-carboxylic acid
CID 104861473
3-(azocane-1-carbonylamino)-2-methylpropanoic acid
CID 62669756
3-(azepane-1-carbonylamino)-2-methylpropanoic acid
CID 62671321
N-[2-(dimethylamino)propyl]piperidine-1-carboxamide
CID 115581577
N-[2-methyl-3-(methylamino)propyl]azepane-1-carboxamide
CID 115302691
3-(hydroxymethyl)-N-(2-methylsulfanylpropyl)azetidine-1-carboxamide
CID 146082032
N-[2-(methylamino)propyl]pyrrolidine-1-carboxamide
CID 103512851
N-(2-amino-3-hydroxybutyl)piperidine-1-carboxamide
CID 79154941
N-(2,3,3-trimethylbutyl)pyrrolidine-1-carboxamide
CID 115629639
N-(2-methylsulfinylpropyl)pyrrolidine-1-carboxamide
CID 115763587
4-methyl-5-(piperidine-1-carbonylamino)pentanoic acid
CID 82682716
(2S)-3-(azocane-1-carbonylamino)-2-hydroxypropanoic acid
CID 107838219

Frequently Asked Questions

What is the IUPAC name of N-(2-methylsulfanylpropyl)piperidine-1-carboxamide?
The IUPAC name of N-(2-methylsulfanylpropyl)piperidine-1-carboxamide (CID 115760436) is N-(2-methylsulfanylpropyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2-methylsulfanylpropyl)piperidine-1-carboxamide?
The canonical SMILES for N-(2-methylsulfanylpropyl)piperidine-1-carboxamide is CSC(C)CNC(=O)N1CCCCC1.
What is the InChIKey of N-(2-methylsulfanylpropyl)piperidine-1-carboxamide?
The InChIKey is VETCTYMPICGFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-9(14-2)8-11-10(13)12-6-4-3-5-7-12/h9H,3-8H2,1-2H3,(H,11,13).
What are the key properties of N-(2-methylsulfanylpropyl)piperidine-1-carboxamide?
N-(2-methylsulfanylpropyl)piperidine-1-carboxamide has a molecular weight of 216.35 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylsulfanylpropyl)piperidine-1-carboxamide is sourced from PubChem (CID 115760436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).