6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide

C11H11N5O2S2 — CID 63328389

IUPAC6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCc1ccncc1NS(=O)(=O)c1c(N)nc2sccn12
InChIInChI=1S/C11H11N5O2S2/c1-7-2-3-13-6-8(7)15-20(17,18)10-9(12)14-11-16(10)4-5-19-11/h2-6,15H,12H2,1H3
InChIKeyXYJJBWKTNJRQNY-UHFFFAOYSA-N
MW309.38 g/mol
LogP1.48
Rot. Bonds3

About 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide

6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 63328389) has the molecular formula C11H11N5O2S2 and a molecular weight of 309.38 g/mol. Its IUPAC name is 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID63328389
Molecular FormulaC11H11N5O2S2
Molecular Weight309.38 g/mol
Exact Mass309.04
IUPAC Name6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCc1ccncc1NS(=O)(=O)c1c(N)nc2sccn12
InChIInChI=1S/C11H11N5O2S2/c1-7-2-3-13-6-8(7)15-20(17,18)10-9(12)14-11-16(10)4-5-19-11/h2-6,15H,12H2,1H3
InChIKeyXYJJBWKTNJRQNY-UHFFFAOYSA-N
XLogP1.48
TPSA102.38 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.38
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 63328389) is 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is Cc1ccncc1NS(=O)(=O)c1c(N)nc2sccn12.
What is the InChIKey of 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is XYJJBWKTNJRQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5O2S2/c1-7-2-3-13-6-8(7)15-20(17,18)10-9(12)14-11-16(10)4-5-19-11/h2-6,15H,12H2,1H3.
What are the key properties of 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 309.38 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 63328389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).