N-(2-piperidin-4-ylethyl)methanesulfonamide

C8H18N2O2S — CID 4090534

IUPACN-(2-piperidin-4-ylethyl)methanesulfonamide
SMILESCS(=O)(=O)NCCC1CCNCC1
InChIInChI=1S/C8H18N2O2S/c1-13(11,12)10-7-4-8-2-5-9-6-3-8/h8-10H,2-7H2,1H3
InChIKeyUGPPYKTUXGONMA-UHFFFAOYSA-N
MW206.31 g/mol
LogP-0.07
Rot. Bonds4

About N-(2-piperidin-4-ylethyl)methanesulfonamide

N-(2-piperidin-4-ylethyl)methanesulfonamide (PubChem CID 4090534) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-(2-piperidin-4-ylethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-piperidin-4-ylethyl)methanesulfonamide
PubChem CID4090534
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN-(2-piperidin-4-ylethyl)methanesulfonamide
SMILESCS(=O)(=O)NCCC1CCNCC1
InChIInChI=1S/C8H18N2O2S/c1-13(11,12)10-7-4-8-2-5-9-6-3-8/h8-10H,2-7H2,1H3
InChIKeyUGPPYKTUXGONMA-UHFFFAOYSA-N
XLogP-0.07
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-4-ylethyl)methanesulfonamide?
The IUPAC name of N-(2-piperidin-4-ylethyl)methanesulfonamide (CID 4090534) is N-(2-piperidin-4-ylethyl)methanesulfonamide.
What is the SMILES notation for N-(2-piperidin-4-ylethyl)methanesulfonamide?
The canonical SMILES for N-(2-piperidin-4-ylethyl)methanesulfonamide is CS(=O)(=O)NCCC1CCNCC1.
What is the InChIKey of N-(2-piperidin-4-ylethyl)methanesulfonamide?
The InChIKey is UGPPYKTUXGONMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-13(11,12)10-7-4-8-2-5-9-6-3-8/h8-10H,2-7H2,1H3.
What are the key properties of N-(2-piperidin-4-ylethyl)methanesulfonamide?
N-(2-piperidin-4-ylethyl)methanesulfonamide has a molecular weight of 206.31 g/mol, XLogP of -0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-4-ylethyl)methanesulfonamide is sourced from PubChem (CID 4090534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).