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

C8H11N5O3S2 — CID 62146624

IUPAC2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide
SMILESCC(NS(=O)(=O)c1c(N)nc2sccn12)C(N)=O
InChIInChI=1S/C8H11N5O3S2/c1-4(6(10)14)12-18(15,16)7-5(9)11-8-13(7)2-3-17-8/h2-4,12H,9H2,1H3,(H2,10,14)
InChIKeyVRWDSFUUSNUXDO-UHFFFAOYSA-N
MW289.34 g/mol
LogP-0.87
Rot. Bonds4

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

2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide (PubChem CID 62146624) has the molecular formula C8H11N5O3S2 and a molecular weight of 289.34 g/mol. Its IUPAC name is 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide.

Molecular Properties

Compound Name2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide
PubChem CID62146624
Molecular FormulaC8H11N5O3S2
Molecular Weight289.34 g/mol
Exact Mass289.03
IUPAC Name2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide
SMILESCC(NS(=O)(=O)c1c(N)nc2sccn12)C(N)=O
InChIInChI=1S/C8H11N5O3S2/c1-4(6(10)14)12-18(15,16)7-5(9)11-8-13(7)2-3-17-8/h2-4,12H,9H2,1H3,(H2,10,14)
InChIKeyVRWDSFUUSNUXDO-UHFFFAOYSA-N
XLogP-0.87
TPSA132.58 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 5-0.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide?
The IUPAC name of 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide (CID 62146624) is 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide.
What is the SMILES notation for 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide?
The canonical SMILES for 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide is CC(NS(=O)(=O)c1c(N)nc2sccn12)C(N)=O.
What is the InChIKey of 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide?
The InChIKey is VRWDSFUUSNUXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O3S2/c1-4(6(10)14)12-18(15,16)7-5(9)11-8-13(7)2-3-17-8/h2-4,12H,9H2,1H3,(H2,10,14).
What are the key properties of 2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide?
2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide has a molecular weight of 289.34 g/mol, XLogP of -0.87, 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]propanamide is sourced from PubChem (CID 62146624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).