N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide

C8H13N5O2S2 — CID 67335531

IUPACN-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide
SMILESCCNc1nn2cc(S(=O)(=O)NCC)nc2s1
InChIInChI=1S/C8H13N5O2S2/c1-3-9-7-12-13-5-6(11-8(13)16-7)17(14,15)10-4-2/h5,10H,3-4H2,1-2H3,(H,9,12)
InChIKeyKXICBTSHVBNSQN-UHFFFAOYSA-N
MW275.36 g/mol
LogP0.52
Rot. Bonds5

About N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide

N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide (PubChem CID 67335531) has the molecular formula C8H13N5O2S2 and a molecular weight of 275.36 g/mol. Its IUPAC name is N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide.

Molecular Properties

Compound NameN-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide
PubChem CID67335531
Molecular FormulaC8H13N5O2S2
Molecular Weight275.36 g/mol
Exact Mass275.05
IUPAC NameN-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide
SMILESCCNc1nn2cc(S(=O)(=O)NCC)nc2s1
InChIInChI=1S/C8H13N5O2S2/c1-3-9-7-12-13-5-6(11-8(13)16-7)17(14,15)10-4-2/h5,10H,3-4H2,1-2H3,(H,9,12)
InChIKeyKXICBTSHVBNSQN-UHFFFAOYSA-N
XLogP0.52
TPSA88.39 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide?
The IUPAC name of N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide (CID 67335531) is N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide.
What is the SMILES notation for N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide?
The canonical SMILES for N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide is CCNc1nn2cc(S(=O)(=O)NCC)nc2s1.
What is the InChIKey of N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide?
The InChIKey is KXICBTSHVBNSQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O2S2/c1-3-9-7-12-13-5-6(11-8(13)16-7)17(14,15)10-4-2/h5,10H,3-4H2,1-2H3,(H,9,12).
What are the key properties of N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide?
N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide has a molecular weight of 275.36 g/mol, XLogP of 0.52, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(ethylamino)imidazo[2,1-b][1,3,4]thiadiazole-6-sulfonamide is sourced from PubChem (CID 67335531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).