2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine

C13H18N6O2S — CID 53318022

IUPAC2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine
SMILESNc1nc(N2CCOCC2)c2sc(N3CCOCC3)nc2n1
InChIInChI=1S/C13H18N6O2S/c14-12-15-10-9(11(17-12)18-1-5-20-6-2-18)22-13(16-10)19-3-7-21-8-4-19/h1-8H2,(H2,14,15,17)
InChIKeyIRZSFBJKLJHCEM-UHFFFAOYSA-N
MW322.39 g/mol
LogP0.34
Rot. Bonds2

About 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine

2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine (PubChem CID 53318022) has the molecular formula C13H18N6O2S and a molecular weight of 322.39 g/mol. Its IUPAC name is 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine.

Molecular Properties

Compound Name2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine
PubChem CID53318022
Molecular FormulaC13H18N6O2S
Molecular Weight322.39 g/mol
Exact Mass322.12
IUPAC Name2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine
SMILESNc1nc(N2CCOCC2)c2sc(N3CCOCC3)nc2n1
InChIInChI=1S/C13H18N6O2S/c14-12-15-10-9(11(17-12)18-1-5-20-6-2-18)22-13(16-10)19-3-7-21-8-4-19/h1-8H2,(H2,14,15,17)
InChIKeyIRZSFBJKLJHCEM-UHFFFAOYSA-N
XLogP0.34
TPSA89.63 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine?
The IUPAC name of 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine (CID 53318022) is 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine.
What is the SMILES notation for 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine?
The canonical SMILES for 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine is Nc1nc(N2CCOCC2)c2sc(N3CCOCC3)nc2n1.
What is the InChIKey of 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine?
The InChIKey is IRZSFBJKLJHCEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O2S/c14-12-15-10-9(11(17-12)18-1-5-20-6-2-18)22-13(16-10)19-3-7-21-8-4-19/h1-8H2,(H2,14,15,17).
What are the key properties of 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine?
2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine has a molecular weight of 322.39 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimorpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-amine is sourced from PubChem (CID 53318022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).