2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide

C11H17N5O3S2 — CID 115357173

IUPAC2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide
SMILESCC(C)(C)NC(=O)CNS(=O)(=O)c1c(N)nc2sccn12
InChIInChI=1S/C11H17N5O3S2/c1-11(2,3)15-7(17)6-13-21(18,19)9-8(12)14-10-16(9)4-5-20-10/h4-5,13H,6,12H2,1-3H3,(H,15,17)
InChIKeyWKFAGJPPQBRAJO-UHFFFAOYSA-N
MW331.42 g/mol
LogP0.17
Rot. Bonds4

About 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide

2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide (PubChem CID 115357173) has the molecular formula C11H17N5O3S2 and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide.

Molecular Properties

Compound Name2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide
PubChem CID115357173
Molecular FormulaC11H17N5O3S2
Molecular Weight331.42 g/mol
Exact Mass331.08
IUPAC Name2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide
SMILESCC(C)(C)NC(=O)CNS(=O)(=O)c1c(N)nc2sccn12
InChIInChI=1S/C11H17N5O3S2/c1-11(2,3)15-7(17)6-13-21(18,19)9-8(12)14-10-16(9)4-5-20-10/h4-5,13H,6,12H2,1-3H3,(H,15,17)
InChIKeyWKFAGJPPQBRAJO-UHFFFAOYSA-N
XLogP0.17
TPSA118.59 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

6-amino-N-(2-ethoxy-2-methylpropyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 114944062
2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-2-methylpropanamide
CID 62152600
6-amino-N-(3,3,3-trifluoropropyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 63227518
6-amino-N-[2-(ethylsulfamoyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 106342310
2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide
CID 62146624
6-amino-N-(2-pyrrolidin-1-ylethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62640219
2-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-propan-2-ylacetamide
CID 60814143
6-amino-N-(2-piperidin-1-ylethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62156779
6-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 106376743
2-[[6-(propylamino)imidazo[2,1-b][1,3]thiazol-5-yl]sulfonylamino]acetamide
CID 62150050
6-amino-N-(1H-imidazol-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 64524170
6-amino-N-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62144732

Frequently Asked Questions

What is the IUPAC name of 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide?
The IUPAC name of 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide (CID 115357173) is 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide.
What is the SMILES notation for 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide?
The canonical SMILES for 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide is CC(C)(C)NC(=O)CNS(=O)(=O)c1c(N)nc2sccn12.
What is the InChIKey of 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide?
The InChIKey is WKFAGJPPQBRAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O3S2/c1-11(2,3)15-7(17)6-13-21(18,19)9-8(12)14-10-16(9)4-5-20-10/h4-5,13H,6,12H2,1-3H3,(H,15,17).
What are the key properties of 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide?
2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide has a molecular weight of 331.42 g/mol, XLogP of 0.17, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-N-tert-butylacetamide is sourced from PubChem (CID 115357173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).