5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide

C12H13ClN4O2S — CID 64607180

IUPAC5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)Nc2ccccn2)cc1Cl
InChIInChI=1S/C12H13ClN4O2S/c1-2-14-12-10(13)7-9(8-16-12)20(18,19)17-11-5-3-4-6-15-11/h3-8H,2H2,1H3,(H,14,16)(H,15,17)
InChIKeyZUWXOMNONJBEBW-UHFFFAOYSA-N
MW312.78 g/mol
LogP2.36
Rot. Bonds5

About 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide

5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide (PubChem CID 64607180) has the molecular formula C12H13ClN4O2S and a molecular weight of 312.78 g/mol. Its IUPAC name is 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide
PubChem CID64607180
Molecular FormulaC12H13ClN4O2S
Molecular Weight312.78 g/mol
Exact Mass312.04
IUPAC Name5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)Nc2ccccn2)cc1Cl
InChIInChI=1S/C12H13ClN4O2S/c1-2-14-12-10(13)7-9(8-16-12)20(18,19)17-11-5-3-4-6-15-11/h3-8H,2H2,1H3,(H,14,16)(H,15,17)
InChIKeyZUWXOMNONJBEBW-UHFFFAOYSA-N
XLogP2.36
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.78
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(ethylamino)-N-pyridin-2-ylpyrimidine-5-sulfonamide
CID 62149006
5-chloro-6-(ethylamino)-N-methyl-N-pyridin-2-ylpyridine-3-sulfonamide
CID 64606979
5-chloro-6-(ethylamino)-N-(thiatriazol-5-yl)pyridine-3-sulfonamide
CID 114914138
5-chloro-6-(ethylamino)pyridine-3-sulfonamide
CID 64608699
5-chloro-6-(ethylamino)-N-(pyridin-3-ylmethyl)pyridine-3-sulfonamide
CID 64606204
5-chloro-6-(ethylamino)-N-pentan-3-ylpyridine-3-sulfonamide
CID 64608495
5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64607730
5-chloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)-6-(ethylamino)pyridine-3-sulfonamide
CID 64600101
5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide
CID 64607000
5-chloro-6-(ethylamino)-N-methyl-N-phenylpyridine-3-sulfonamide
CID 64606805
5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide
CID 64600545
5-chloro-6-(ethylamino)-N-(2-pyridin-3-ylethyl)pyridine-3-sulfonamide
CID 136574861

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide (CID 64607180) is 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide is CCNc1ncc(S(=O)(=O)Nc2ccccn2)cc1Cl.
What is the InChIKey of 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide?
The InChIKey is ZUWXOMNONJBEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN4O2S/c1-2-14-12-10(13)7-9(8-16-12)20(18,19)17-11-5-3-4-6-15-11/h3-8H,2H2,1H3,(H,14,16)(H,15,17).
What are the key properties of 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide?
5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide has a molecular weight of 312.78 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide is sourced from PubChem (CID 64607180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).