N-(1-piperidin-3-ylethyl)methanesulfonamide

C8H18N2O2S — CID 43523468

IUPACN-(1-piperidin-3-ylethyl)methanesulfonamide
SMILESCC(NS(C)(=O)=O)C1CCCNC1
InChIInChI=1S/C8H18N2O2S/c1-7(10-13(2,11)12)8-4-3-5-9-6-8/h7-10H,3-6H2,1-2H3
InChIKeyMZAHKZTYVAYGSP-UHFFFAOYSA-N
MW206.31 g/mol
LogP-0.08
Rot. Bonds3

About N-(1-piperidin-3-ylethyl)methanesulfonamide

N-(1-piperidin-3-ylethyl)methanesulfonamide (PubChem CID 43523468) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-(1-piperidin-3-ylethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(1-piperidin-3-ylethyl)methanesulfonamide
PubChem CID43523468
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN-(1-piperidin-3-ylethyl)methanesulfonamide
SMILESCC(NS(C)(=O)=O)C1CCCNC1
InChIInChI=1S/C8H18N2O2S/c1-7(10-13(2,11)12)8-4-3-5-9-6-8/h7-10H,3-6H2,1-2H3
InChIKeyMZAHKZTYVAYGSP-UHFFFAOYSA-N
XLogP-0.08
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-4-ylmethyl)methanesulfonamide
CID 5095908
{1-[1-(Ethanesulfonyl)piperidin-4-yl]ethyl}(methyl)amine
CID 63854893
N-(piperidin-3-ylmethyl)methanesulfonamide
CID 4343050
N-(Piperidin-4-ylmethyl)methanesulfonamide hydrochloride
CID 44630864
N-Methyl-1-(methylsulfonyl)-4-piperidinamine
CID 18758393
N-[2-(1-methylpiperidin-4-yl)ethyl]methanesulfonamide
CID 72025553
N-[2-(piperidin-2-yl)ethyl]methanesulfonamide
CID 4090533
N-((piperidin-3-yl)methyl)propane-2-sulfonamide
CID 47002636
(3S,4R)-3-methyl-1-(methylsulfonyl)piperidin-4-amine
CID 98227926
1-Methanesulfonyl-4-(pyrrolidin-3-YL)piperidine
CID 90488137
N-((1-isopropylpiperidin-4-yl)methyl)propane-1-sulfonamide
CID 45558506
1-cyclohexyl-N-(1-methylpiperidin-4-yl)methanesulfonamide
CID 56790967

Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-3-ylethyl)methanesulfonamide?
The IUPAC name of N-(1-piperidin-3-ylethyl)methanesulfonamide (CID 43523468) is N-(1-piperidin-3-ylethyl)methanesulfonamide.
What is the SMILES notation for N-(1-piperidin-3-ylethyl)methanesulfonamide?
The canonical SMILES for N-(1-piperidin-3-ylethyl)methanesulfonamide is CC(NS(C)(=O)=O)C1CCCNC1.
What is the InChIKey of N-(1-piperidin-3-ylethyl)methanesulfonamide?
The InChIKey is MZAHKZTYVAYGSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-7(10-13(2,11)12)8-4-3-5-9-6-8/h7-10H,3-6H2,1-2H3.
What are the key properties of N-(1-piperidin-3-ylethyl)methanesulfonamide?
N-(1-piperidin-3-ylethyl)methanesulfonamide has a molecular weight of 206.31 g/mol, XLogP of -0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-3-ylethyl)methanesulfonamide is sourced from PubChem (CID 43523468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).