2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid

C15H8N6O2 — CID 71280183

IUPAC2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid
SMILESN#Cc1ccn2c(-c3cnc4[nH]cc(C(=O)O)c4n3)cnc2c1
InChIInChI=1S/C15H8N6O2/c16-4-8-1-2-21-11(7-17-12(21)3-8)10-6-19-14-13(20-10)9(5-18-14)15(22)23/h1-3,5-7H,(H,18,19)(H,22,23)
InChIKeyZXHUOQNSVKZLOU-UHFFFAOYSA-N
MW304.27 g/mol
LogP1.84
Rot. Bonds2

About 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid

2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid (PubChem CID 71280183) has the molecular formula C15H8N6O2 and a molecular weight of 304.27 g/mol. Its IUPAC name is 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid.

Molecular Properties

Compound Name2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid
PubChem CID71280183
Molecular FormulaC15H8N6O2
Molecular Weight304.27 g/mol
Exact Mass304.07
IUPAC Name2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid
SMILESN#Cc1ccn2c(-c3cnc4[nH]cc(C(=O)O)c4n3)cnc2c1
InChIInChI=1S/C15H8N6O2/c16-4-8-1-2-21-11(7-17-12(21)3-8)10-6-19-14-13(20-10)9(5-18-14)15(22)23/h1-3,5-7H,(H,18,19)(H,22,23)
InChIKeyZXHUOQNSVKZLOU-UHFFFAOYSA-N
XLogP1.84
TPSA119.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.27
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid?
The IUPAC name of 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid (CID 71280183) is 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid.
What is the SMILES notation for 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid?
The canonical SMILES for 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid is N#Cc1ccn2c(-c3cnc4[nH]cc(C(=O)O)c4n3)cnc2c1.
What is the InChIKey of 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid?
The InChIKey is ZXHUOQNSVKZLOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8N6O2/c16-4-8-1-2-21-11(7-17-12(21)3-8)10-6-19-14-13(20-10)9(5-18-14)15(22)23/h1-3,5-7H,(H,18,19)(H,22,23).
What are the key properties of 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid?
2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid has a molecular weight of 304.27 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-cyanoimidazo[1,2-a]pyridin-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid is sourced from PubChem (CID 71280183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).