5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine

C8H10N4S2 — CID 12526370

IUPAC5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine
SMILESNc1snc2nc(N3CCCC3)sc12
InChIInChI=1S/C8H10N4S2/c9-6-5-7(11-14-6)10-8(13-5)12-3-1-2-4-12/h1-4,9H2
InChIKeyVGKBCSUFSFOIMN-UHFFFAOYSA-N
MW226.33 g/mol
LogP1.94
Rot. Bonds1

About 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine

5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine (PubChem CID 12526370) has the molecular formula C8H10N4S2 and a molecular weight of 226.33 g/mol. Its IUPAC name is 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine.

Molecular Properties

Compound Name5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine
PubChem CID12526370
Molecular FormulaC8H10N4S2
Molecular Weight226.33 g/mol
Exact Mass226.03
IUPAC Name5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine
SMILESNc1snc2nc(N3CCCC3)sc12
InChIInChI=1S/C8H10N4S2/c9-6-5-7(11-14-6)10-8(13-5)12-3-1-2-4-12/h1-4,9H2
InChIKeyVGKBCSUFSFOIMN-UHFFFAOYSA-N
XLogP1.94
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.33
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine?
The IUPAC name of 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine (CID 12526370) is 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine.
What is the SMILES notation for 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine?
The canonical SMILES for 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine is Nc1snc2nc(N3CCCC3)sc12.
What is the InChIKey of 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine?
The InChIKey is VGKBCSUFSFOIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4S2/c9-6-5-7(11-14-6)10-8(13-5)12-3-1-2-4-12/h1-4,9H2.
What are the key properties of 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine?
5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine has a molecular weight of 226.33 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolidin-1-yl-[1,2]thiazolo[3,4-d][1,3]thiazol-3-amine is sourced from PubChem (CID 12526370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).