N-(piperidin-4-ylmethyl)methanesulfonamide

C7H16N2O2S — CID 5095908

IUPACN-(piperidin-4-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)NCC1CCNCC1
InChIInChI=1S/C7H16N2O2S/c1-12(10,11)9-6-7-2-4-8-5-3-7/h7-9H,2-6H2,1H3
InChIKeyLULUGSQUPICPQM-UHFFFAOYSA-N
MW192.28 g/mol
LogP-0.46
Rot. Bonds3

About N-(piperidin-4-ylmethyl)methanesulfonamide

N-(piperidin-4-ylmethyl)methanesulfonamide (PubChem CID 5095908) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is N-(piperidin-4-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(piperidin-4-ylmethyl)methanesulfonamide
PubChem CID5095908
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC NameN-(piperidin-4-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)NCC1CCNCC1
InChIInChI=1S/C7H16N2O2S/c1-12(10,11)9-6-7-2-4-8-5-3-7/h7-9H,2-6H2,1H3
InChIKeyLULUGSQUPICPQM-UHFFFAOYSA-N
XLogP-0.46
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(piperidin-4-ylmethyl)methanesulfonamide?
The IUPAC name of N-(piperidin-4-ylmethyl)methanesulfonamide (CID 5095908) is N-(piperidin-4-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-(piperidin-4-ylmethyl)methanesulfonamide?
The canonical SMILES for N-(piperidin-4-ylmethyl)methanesulfonamide is CS(=O)(=O)NCC1CCNCC1.
What is the InChIKey of N-(piperidin-4-ylmethyl)methanesulfonamide?
The InChIKey is LULUGSQUPICPQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-12(10,11)9-6-7-2-4-8-5-3-7/h7-9H,2-6H2,1H3.
What are the key properties of N-(piperidin-4-ylmethyl)methanesulfonamide?
N-(piperidin-4-ylmethyl)methanesulfonamide has a molecular weight of 192.28 g/mol, XLogP of -0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-4-ylmethyl)methanesulfonamide is sourced from PubChem (CID 5095908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).