5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole

C9H7N5S — CID 68892365

IUPAC5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole
SMILESCc1ncsc1-c1nc2nccnc2[nH]1
InChIInChI=1S/C9H7N5S/c1-5-6(15-4-12-5)7-13-8-9(14-7)11-3-2-10-8/h2-4H,1H3,(H,10,11,13,14)
InChIKeyWPNRGWVJAZVANR-UHFFFAOYSA-N
MW217.26 g/mol
LogP1.78
Rot. Bonds1

About 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole

5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole (PubChem CID 68892365) has the molecular formula C9H7N5S and a molecular weight of 217.26 g/mol. Its IUPAC name is 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole
PubChem CID68892365
Molecular FormulaC9H7N5S
Molecular Weight217.26 g/mol
Exact Mass217.04
IUPAC Name5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole
SMILESCc1ncsc1-c1nc2nccnc2[nH]1
InChIInChI=1S/C9H7N5S/c1-5-6(15-4-12-5)7-13-8-9(14-7)11-3-2-10-8/h2-4H,1H3,(H,10,11,13,14)
InChIKeyWPNRGWVJAZVANR-UHFFFAOYSA-N
XLogP1.78
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole?
The IUPAC name of 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole (CID 68892365) is 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole.
What is the SMILES notation for 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole?
The canonical SMILES for 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole is Cc1ncsc1-c1nc2nccnc2[nH]1.
What is the InChIKey of 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole?
The InChIKey is WPNRGWVJAZVANR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N5S/c1-5-6(15-4-12-5)7-13-8-9(14-7)11-3-2-10-8/h2-4H,1H3,(H,10,11,13,14).
What are the key properties of 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole?
5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole has a molecular weight of 217.26 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-imidazo[4,5-b]pyrazin-2-yl)-4-methyl-1,3-thiazole is sourced from PubChem (CID 68892365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).