N-butyl-N-methylpiperidine-1-sulfonamide

C10H22N2O2S — CID 52559151

IUPACN-butyl-N-methylpiperidine-1-sulfonamide
SMILESCCCCN(C)S(=O)(=O)N1CCCCC1
InChIInChI=1S/C10H22N2O2S/c1-3-4-8-11(2)15(13,14)12-9-6-5-7-10-12/h3-10H2,1-2H3
InChIKeyAQXYSNXSZPJIDS-UHFFFAOYSA-N
MW234.36 g/mol
LogP1.45
Rot. Bonds5

About N-butyl-N-methylpiperidine-1-sulfonamide

N-butyl-N-methylpiperidine-1-sulfonamide (PubChem CID 52559151) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is N-butyl-N-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-butyl-N-methylpiperidine-1-sulfonamide
PubChem CID52559151
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC NameN-butyl-N-methylpiperidine-1-sulfonamide
SMILESCCCCN(C)S(=O)(=O)N1CCCCC1
InChIInChI=1S/C10H22N2O2S/c1-3-4-8-11(2)15(13,14)12-9-6-5-7-10-12/h3-10H2,1-2H3
InChIKeyAQXYSNXSZPJIDS-UHFFFAOYSA-N
XLogP1.45
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-methylpiperidine-1-sulfonamide?
The IUPAC name of N-butyl-N-methylpiperidine-1-sulfonamide (CID 52559151) is N-butyl-N-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-butyl-N-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-butyl-N-methylpiperidine-1-sulfonamide is CCCCN(C)S(=O)(=O)N1CCCCC1.
What is the InChIKey of N-butyl-N-methylpiperidine-1-sulfonamide?
The InChIKey is AQXYSNXSZPJIDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-3-4-8-11(2)15(13,14)12-9-6-5-7-10-12/h3-10H2,1-2H3.
What are the key properties of N-butyl-N-methylpiperidine-1-sulfonamide?
N-butyl-N-methylpiperidine-1-sulfonamide has a molecular weight of 234.36 g/mol, XLogP of 1.45, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 52559151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).