N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide

C12H14N4O3S — CID 62150607

IUPACN-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)Nc1ccc(OC)nc1
InChIInChI=1S/C12H14N4O3S/c1-13-12-10(4-3-7-14-12)20(17,18)16-9-5-6-11(19-2)15-8-9/h3-8,16H,1-2H3,(H,13,14)
InChIKeyJQVUEGRMSIJOII-UHFFFAOYSA-N
MW294.34 g/mol
LogP1.33
Rot. Bonds5

About N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide

N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide (PubChem CID 62150607) has the molecular formula C12H14N4O3S and a molecular weight of 294.34 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide
PubChem CID62150607
Molecular FormulaC12H14N4O3S
Molecular Weight294.34 g/mol
Exact Mass294.08
IUPAC NameN-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)Nc1ccc(OC)nc1
InChIInChI=1S/C12H14N4O3S/c1-13-12-10(4-3-7-14-12)20(17,18)16-9-5-6-11(19-2)15-8-9/h3-8,16H,1-2H3,(H,13,14)
InChIKeyJQVUEGRMSIJOII-UHFFFAOYSA-N
XLogP1.33
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.34
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide (CID 62150607) is N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide is CNc1ncccc1S(=O)(=O)Nc1ccc(OC)nc1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide?
The InChIKey is JQVUEGRMSIJOII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3S/c1-13-12-10(4-3-7-14-12)20(17,18)16-9-5-6-11(19-2)15-8-9/h3-8,16H,1-2H3,(H,13,14).
What are the key properties of N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide?
N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide has a molecular weight of 294.34 g/mol, XLogP of 1.33, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62150607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).