1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine

C7H8N4S — CID 106678219

IUPAC1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine
SMILESCC(N)c1nc2nccnc2s1
InChIInChI=1S/C7H8N4S/c1-4(8)6-11-5-7(12-6)10-3-2-9-5/h2-4H,8H2,1H3
InChIKeyWZTZMBWYFJKLDT-UHFFFAOYSA-N
MW180.24 g/mol
LogP1.11
Rot. Bonds1

About 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine

1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine (PubChem CID 106678219) has the molecular formula C7H8N4S and a molecular weight of 180.24 g/mol. Its IUPAC name is 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine.

Molecular Properties

Compound Name1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine
PubChem CID106678219
Molecular FormulaC7H8N4S
Molecular Weight180.24 g/mol
Exact Mass180.05
IUPAC Name1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine
SMILESCC(N)c1nc2nccnc2s1
InChIInChI=1S/C7H8N4S/c1-4(8)6-11-5-7(12-6)10-3-2-9-5/h2-4H,8H2,1H3
InChIKeyWZTZMBWYFJKLDT-UHFFFAOYSA-N
XLogP1.11
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.24
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine?
The IUPAC name of 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine (CID 106678219) is 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine.
What is the SMILES notation for 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine?
The canonical SMILES for 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine is CC(N)c1nc2nccnc2s1.
What is the InChIKey of 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine?
The InChIKey is WZTZMBWYFJKLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4S/c1-4(8)6-11-5-7(12-6)10-3-2-9-5/h2-4H,8H2,1H3.
What are the key properties of 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine?
1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine has a molecular weight of 180.24 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-([1,3]thiazolo[4,5-b]pyrazin-2-yl)ethanamine is sourced from PubChem (CID 106678219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).