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

C20H19N5O — CID 153418150

IUPAC8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine
SMILES[2H]C(C)(C)N1CN(c2c(C)ccc3c2oc2ncccc23)c2nccnc21
InChIInChI=1S/C20H19N5O/c1-12(2)24-11-25(19-18(24)21-9-10-22-19)16-13(3)6-7-14-15-5-4-8-23-20(15)26-17(14)16/h4-10,12H,11H2,1-3H3/i12D
InChIKeyTUIRUWXBHNBTPZ-UQBWLURTSA-N
MW346.41 g/mol
LogP4.40
Rot. Bonds2

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

8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine (PubChem CID 153418150) has the molecular formula C20H19N5O and a molecular weight of 346.41 g/mol. Its IUPAC name is 8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine
PubChem CID153418150
Molecular FormulaC20H19N5O
Molecular Weight346.41 g/mol
Exact Mass346.17
IUPAC Name8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine
SMILES[2H]C(C)(C)N1CN(c2c(C)ccc3c2oc2ncccc23)c2nccnc21
InChIInChI=1S/C20H19N5O/c1-12(2)24-11-25(19-18(24)21-9-10-22-19)16-13(3)6-7-14-15-5-4-8-23-20(15)26-17(14)16/h4-10,12H,11H2,1-3H3/i12D
InChIKeyTUIRUWXBHNBTPZ-UQBWLURTSA-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 ≤ 500346.41
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 140884123
CID 140884123
7-methyl-8-[2-methyl-3-(1,1,1,2-tetradeuteriopropan-2-yl)-2H-imidazo[4,5-b]pyridin-1-yl]-[1]benzofuro[2,3-b]pyridine
CID 162269283
7-methyl-8-[(2S)-2-methyl-1-propan-2-yl-2H-imidazo[4,5-b]pyridin-3-yl]-[1]benzofuro[2,3-b]pyridine
CID 118074735
bis(8-[3-(2-deuteriopropan-2-yl)-2-methyl-2H-benzimidazol-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine);bis(8-[1-(2-deuteriopropan-2-yl)-2-methyl-2H-imidazo[4,5-b]pyridin-3-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine);8-(1,2-dimethyl-2H-imidazo[4,5-b]pyridin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine
CID 162296359
ethane;7-methyl-8-(1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-[1]benzofuro[2,3-b]pyridine;7-methyl-8-(1-methyl-2H-imidazo[4,5-b]pyridin-3-yl)-[1]benzofuro[2,3-b]pyridine;7-methyl-8-(3-methyl-2H-imidazo[4,5-b]pyridin-1-yl)-[1]benzofuro[2,3-b]pyridine;7-methyl-8-(3-phenyl-2H-benzimidazol-1-yl)-[1]benzofuro[2,3-b]pyridine;7-methyl-8-(3-phenyl-2H-imidazol-1-yl)-[1]benzofuro[2,3-b]pyridine
CID 158722082
2,7-dimethyl-8-[(2S)-2-methyl-1-propan-2-yl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl]-[1]benzofuro[2,3-b]pyridine
CID 152967807
8-(2-ethyl-1-methyl-2H-imidazo[4,5-b]pyrazin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine
CID 146176691
8-[3-(2-deuteriopropan-2-yl)-2-methyl-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine;7-methyl-8-[2-methyl-3-(1,1,1,2-tetradeuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-[1]benzofuro[2,3-b]pyridine;7-methyl-8-[2-methyl-3-(1,1,1,2-tetradeuteriopropan-2-yl)-2H-imidazo[4,5-b]pyridin-1-yl]-[1]benzofuro[2,3-b]pyridine;7-methyl-8-[2-methyl-3-(trideuteriomethyl)-2H-imidazo[4,5-b]pyrazin-1-yl]-[1]benzofuro[2,3-b]pyridine
CID 162301948
8-[(2S)-1-(2-deuteriopropan-2-yl)-2-methyl-2H-imidazo[4,5-b]pyridin-3-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine;bis(8-[(2R)-3-(2-deuteriopropan-2-yl)-2-methyl-2H-imidazo[4,5-b]pyridin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine);7-methyl-8-[(2S)-2-methyl-3-(trideuteriomethyl)-2H-imidazo[4,5-b]pyrazin-1-yl]-[1]benzofuro[2,3-b]pyridine;7-methyl-8-[(2R)-2-methyl-3-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-1-yl]-[1]benzofuro[2,3-b]pyridine
CID 158463883
8-(2-ethyl-1-propan-2-yl-2H-imidazo[4,5-b]pyridin-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine
CID 137448454
7-methyl-8-[(2R)-2-methyl-3-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-1-yl]-[1]benzofuro[2,3-b]pyridine
CID 140884140
CID 140884093
CID 140884093

Frequently Asked Questions

What is the IUPAC name of 8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine (CID 153418150) is 8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine is [2H]C(C)(C)N1CN(c2c(C)ccc3c2oc2ncccc23)c2nccnc21.
What is the InChIKey of 8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine?
The InChIKey is TUIRUWXBHNBTPZ-UQBWLURTSA-N. The full InChI is InChI=1S/C20H19N5O/c1-12(2)24-11-25(19-18(24)21-9-10-22-19)16-13(3)6-7-14-15-5-4-8-23-20(15)26-17(14)16/h4-10,12H,11H2,1-3H3/i12D.
What are the key properties of 8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine?
8-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine has a molecular weight of 346.41 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-[3-(2-deuteriopropan-2-yl)-2H-imidazo[4,5-b]pyrazin-1-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 153418150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).