N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide

C11H17N3O3S — CID 43629299

IUPACN-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCN1CCC(NS(=O)(=O)c2ccc(=O)[nH]c2)CC1
InChIInChI=1S/C11H17N3O3S/c1-14-6-4-9(5-7-14)13-18(16,17)10-2-3-11(15)12-8-10/h2-3,8-9,13H,4-7H2,1H3,(H,12,15)
InChIKeyAZNZGGPLDMEFFQ-UHFFFAOYSA-N
MW271.34 g/mol
LogP-0.25
Rot. Bonds3

About N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide

N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 43629299) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID43629299
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC NameN-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCN1CCC(NS(=O)(=O)c2ccc(=O)[nH]c2)CC1
InChIInChI=1S/C11H17N3O3S/c1-14-6-4-9(5-7-14)13-18(16,17)10-2-3-11(15)12-8-10/h2-3,8-9,13H,4-7H2,1H3,(H,12,15)
InChIKeyAZNZGGPLDMEFFQ-UHFFFAOYSA-N
XLogP-0.25
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide (CID 43629299) is N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide is CN1CCC(NS(=O)(=O)c2ccc(=O)[nH]c2)CC1.
What is the InChIKey of N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is AZNZGGPLDMEFFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-14-6-4-9(5-7-14)13-18(16,17)10-2-3-11(15)12-8-10/h2-3,8-9,13H,4-7H2,1H3,(H,12,15).
What are the key properties of N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide?
N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 271.34 g/mol, XLogP of -0.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 43629299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).