2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid

C11H15N3O4S — CID 63654456

IUPAC2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C11H15N3O4S/c15-11(16)9-5-4-6-12-10(9)13-19(17,18)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2,(H,12,13)(H,15,16)
InChIKeyLNPQWXLXNOIQCS-UHFFFAOYSA-N
MW285.32 g/mol
LogP0.92
Rot. Bonds4

About 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid

2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid (PubChem CID 63654456) has the molecular formula C11H15N3O4S and a molecular weight of 285.32 g/mol. Its IUPAC name is 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid
PubChem CID63654456
Molecular FormulaC11H15N3O4S
Molecular Weight285.32 g/mol
Exact Mass285.08
IUPAC Name2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C11H15N3O4S/c15-11(16)9-5-4-6-12-10(9)13-19(17,18)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2,(H,12,13)(H,15,16)
InChIKeyLNPQWXLXNOIQCS-UHFFFAOYSA-N
XLogP0.92
TPSA99.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid?
The IUPAC name of 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid (CID 63654456) is 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid?
The canonical SMILES for 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid is O=C(O)c1cccnc1NS(=O)(=O)N1CCCCC1.
What is the InChIKey of 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid?
The InChIKey is LNPQWXLXNOIQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4S/c15-11(16)9-5-4-6-12-10(9)13-19(17,18)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2,(H,12,13)(H,15,16).
What are the key properties of 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid?
2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid has a molecular weight of 285.32 g/mol, XLogP of 0.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(piperidin-1-ylsulfonylamino)pyridine-3-carboxylic acid is sourced from PubChem (CID 63654456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).