4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide

C11H18N4O3S — CID 176690570

IUPAC4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide
SMILESCN1CCN(S(=O)(=O)Nc2ccc(=O)n(C)c2)CC1
InChIInChI=1S/C11H18N4O3S/c1-13-5-7-15(8-6-13)19(17,18)12-10-3-4-11(16)14(2)9-10/h3-4,9,12H,5-8H2,1-2H3
InChIKeyFQUHYSRYRRPLNC-UHFFFAOYSA-N
MW286.36 g/mol
LogP-0.71
Rot. Bonds3

About 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide

4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide (PubChem CID 176690570) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide.

Molecular Properties

Compound Name4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide
PubChem CID176690570
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC Name4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide
SMILESCN1CCN(S(=O)(=O)Nc2ccc(=O)n(C)c2)CC1
InChIInChI=1S/C11H18N4O3S/c1-13-5-7-15(8-6-13)19(17,18)12-10-3-4-11(16)14(2)9-10/h3-4,9,12H,5-8H2,1-2H3
InChIKeyFQUHYSRYRRPLNC-UHFFFAOYSA-N
XLogP-0.71
TPSA74.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 5-0.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide?
The IUPAC name of 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide (CID 176690570) is 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide.
What is the SMILES notation for 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide?
The canonical SMILES for 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide is CN1CCN(S(=O)(=O)Nc2ccc(=O)n(C)c2)CC1.
What is the InChIKey of 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide?
The InChIKey is FQUHYSRYRRPLNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-13-5-7-15(8-6-13)19(17,18)12-10-3-4-11(16)14(2)9-10/h3-4,9,12H,5-8H2,1-2H3.
What are the key properties of 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide?
4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide has a molecular weight of 286.36 g/mol, XLogP of -0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)piperazine-1-sulfonamide is sourced from PubChem (CID 176690570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).