6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide

C13H16N4O2S — CID 79043938

IUPAC6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2cccnc2C)cn1
InChIInChI=1S/C13H16N4O2S/c1-3-14-13-7-6-11(9-16-13)20(18,19)17-12-5-4-8-15-10(12)2/h4-9,17H,3H2,1-2H3,(H,14,16)
InChIKeyHBBMAPSOARMJRG-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.02
Rot. Bonds5

About 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide

6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide (PubChem CID 79043938) has the molecular formula C13H16N4O2S and a molecular weight of 292.36 g/mol. Its IUPAC name is 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide
PubChem CID79043938
Molecular FormulaC13H16N4O2S
Molecular Weight292.36 g/mol
Exact Mass292.10
IUPAC Name6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2cccnc2C)cn1
InChIInChI=1S/C13H16N4O2S/c1-3-14-13-7-6-11(9-16-13)20(18,19)17-12-5-4-8-15-10(12)2/h4-9,17H,3H2,1-2H3,(H,14,16)
InChIKeyHBBMAPSOARMJRG-UHFFFAOYSA-N
XLogP2.02
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide?
The IUPAC name of 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide (CID 79043938) is 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide is CCNc1ccc(S(=O)(=O)Nc2cccnc2C)cn1.
What is the InChIKey of 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide?
The InChIKey is HBBMAPSOARMJRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2S/c1-3-14-13-7-6-11(9-16-13)20(18,19)17-12-5-4-8-15-10(12)2/h4-9,17H,3H2,1-2H3,(H,14,16).
What are the key properties of 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide?
6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide has a molecular weight of 292.36 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide is sourced from PubChem (CID 79043938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).