6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine

C11H8N4S — CID 90467781

IUPAC6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine
SMILESNc1snc2cc(-c3cccnc3)cnc12
InChIInChI=1S/C11H8N4S/c12-11-10-9(15-16-11)4-8(6-14-10)7-2-1-3-13-5-7/h1-6H,12H2
InChIKeyHQEYIJFVQZITMN-UHFFFAOYSA-N
MW228.28 g/mol
LogP2.34
Rot. Bonds1

About 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine

6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine (PubChem CID 90467781) has the molecular formula C11H8N4S and a molecular weight of 228.28 g/mol. Its IUPAC name is 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound Name6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine
PubChem CID90467781
Molecular FormulaC11H8N4S
Molecular Weight228.28 g/mol
Exact Mass228.05
IUPAC Name6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine
SMILESNc1snc2cc(-c3cccnc3)cnc12
InChIInChI=1S/C11H8N4S/c12-11-10-9(15-16-11)4-8(6-14-10)7-2-1-3-13-5-7/h1-6H,12H2
InChIKeyHQEYIJFVQZITMN-UHFFFAOYSA-N
XLogP2.34
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine?
The IUPAC name of 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine (CID 90467781) is 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine is Nc1snc2cc(-c3cccnc3)cnc12.
What is the InChIKey of 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine?
The InChIKey is HQEYIJFVQZITMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4S/c12-11-10-9(15-16-11)4-8(6-14-10)7-2-1-3-13-5-7/h1-6H,12H2.
What are the key properties of 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine?
6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine has a molecular weight of 228.28 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyridin-3-yl-[1,2]thiazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 90467781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).