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

C11H16N4O3S2 — CID 62157340

IUPAC6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCN(CC1CCCO1)S(=O)(=O)c1c(N)nc2sccn12
InChIInChI=1S/C11H16N4O3S2/c1-14(7-8-3-2-5-18-8)20(16,17)10-9(12)13-11-15(10)4-6-19-11/h4,6,8H,2-3,5,7,12H2,1H3
InChIKeySOGFBTLZCSKCBM-UHFFFAOYSA-N
MW316.41 g/mol
LogP0.78
Rot. Bonds4

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

6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 62157340) has the molecular formula C11H16N4O3S2 and a molecular weight of 316.41 g/mol. Its IUPAC name is 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID62157340
Molecular FormulaC11H16N4O3S2
Molecular Weight316.41 g/mol
Exact Mass316.07
IUPAC Name6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCN(CC1CCCO1)S(=O)(=O)c1c(N)nc2sccn12
InChIInChI=1S/C11H16N4O3S2/c1-14(7-8-3-2-5-18-8)20(16,17)10-9(12)13-11-15(10)4-6-19-11/h4,6,8H,2-3,5,7,12H2,1H3
InChIKeySOGFBTLZCSKCBM-UHFFFAOYSA-N
XLogP0.78
TPSA89.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 62157340) is 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is CN(CC1CCCO1)S(=O)(=O)c1c(N)nc2sccn12.
What is the InChIKey of 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is SOGFBTLZCSKCBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3S2/c1-14(7-8-3-2-5-18-8)20(16,17)10-9(12)13-11-15(10)4-6-19-11/h4,6,8H,2-3,5,7,12H2,1H3.
What are the key properties of 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 316.41 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-methyl-N-(oxolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 62157340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).