8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine

C20H19N5O — CID 146176691

IUPAC8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine
SMILESCCC1N(C)c2nccnc2N1c1c(C)ccc2c1oc1ncccc12
InChIInChI=1S/C20H19N5O/c1-4-15-24(3)18-19(22-11-10-21-18)25(15)16-12(2)7-8-13-14-6-5-9-23-20(14)26-17(13)16/h5-11,15H,4H2,1-3H3
InChIKeyMOHJKRFVQNWONE-UHFFFAOYSA-N
MW345.41 g/mol
LogP4.40
Rot. Bonds2

About 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine

8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine (PubChem CID 146176691) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine
PubChem CID146176691
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC Name8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine
SMILESCCC1N(C)c2nccnc2N1c1c(C)ccc2c1oc1ncccc12
InChIInChI=1S/C20H19N5O/c1-4-15-24(3)18-19(22-11-10-21-18)25(15)16-12(2)7-8-13-14-6-5-9-23-20(14)26-17(13)16/h5-11,15H,4H2,1-3H3
InChIKeyMOHJKRFVQNWONE-UHFFFAOYSA-N
XLogP4.40
TPSA58.29 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine (CID 146176691) is 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine is CCC1N(C)c2nccnc2N1c1c(C)ccc2c1oc1ncccc12.
What is the InChIKey of 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine?
The InChIKey is MOHJKRFVQNWONE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-4-15-24(3)18-19(22-11-10-21-18)25(15)16-12(2)7-8-13-14-6-5-9-23-20(14)26-17(13)16/h5-11,15H,4H2,1-3H3.
What are the key properties of 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine?
8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine has a molecular weight of 345.41 g/mol, XLogP of 4.40, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 146176691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).