2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide

C9H11N5O2S2 — CID 62162458

IUPAC2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)Nc2nncs2)ccn1
InChIInChI=1S/C9H11N5O2S2/c1-2-10-8-5-7(3-4-11-8)18(15,16)14-9-13-12-6-17-9/h3-6H,2H2,1H3,(H,10,11)(H,13,14)
InChIKeyCVFRLZWQAKUVRH-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.17
Rot. Bonds5

About 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide

2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide (PubChem CID 62162458) has the molecular formula C9H11N5O2S2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide
PubChem CID62162458
Molecular FormulaC9H11N5O2S2
Molecular Weight285.35 g/mol
Exact Mass285.04
IUPAC Name2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)Nc2nncs2)ccn1
InChIInChI=1S/C9H11N5O2S2/c1-2-10-8-5-7(3-4-11-8)18(15,16)14-9-13-12-6-17-9/h3-6H,2H2,1H3,(H,10,11)(H,13,14)
InChIKeyCVFRLZWQAKUVRH-UHFFFAOYSA-N
XLogP1.17
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide (CID 62162458) is 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)Nc2nncs2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide?
The InChIKey is CVFRLZWQAKUVRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O2S2/c1-2-10-8-5-7(3-4-11-8)18(15,16)14-9-13-12-6-17-9/h3-6H,2H2,1H3,(H,10,11)(H,13,14).
What are the key properties of 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide?
2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide has a molecular weight of 285.35 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide is sourced from PubChem (CID 62162458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).