2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine

C24H15N3O2 — CID 153444870

IUPAC2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(n1)oc1c(-c3ncnc4cc(-c5ccccc5)oc34)cccc12
InChIInChI=1S/C24H15N3O2/c1-14-10-11-17-16-8-5-9-18(22(16)29-24(17)27-14)21-23-19(25-13-26-21)12-20(28-23)15-6-3-2-4-7-15/h2-13H,1H3
InChIKeyBOMZTQDHRAQXFX-UHFFFAOYSA-N
MW377.40 g/mol
LogP6.16
Rot. Bonds2

About 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine

2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine (PubChem CID 153444870) has the molecular formula C24H15N3O2 and a molecular weight of 377.40 g/mol. Its IUPAC name is 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine
PubChem CID153444870
Molecular FormulaC24H15N3O2
Molecular Weight377.40 g/mol
Exact Mass377.12
IUPAC Name2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(n1)oc1c(-c3ncnc4cc(-c5ccccc5)oc34)cccc12
InChIInChI=1S/C24H15N3O2/c1-14-10-11-17-16-8-5-9-18(22(16)29-24(17)27-14)21-23-19(25-13-26-21)12-20(28-23)15-6-3-2-4-7-15/h2-13H,1H3
InChIKeyBOMZTQDHRAQXFX-UHFFFAOYSA-N
XLogP6.16
TPSA64.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.40
LogP ≤ 56.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-8-(2-phenylfuro[3,2-b]pyridin-5-yl)-[1]benzofuro[2,3-b]pyridine
CID 155629013
2-methyl-8-[4-(4-phenylnaphthalen-1-yl)-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 176778940
2-methyl-8-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]pyridine
CID 140760585
8-[2-[2,6-di(propan-2-yl)phenyl]furo[2,3-c]pyridin-7-yl]-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 153444925
[6-(2-methyl-[1]benzofuro[2,3-b]pyridin-8-yl)-2-pyridinyl]-phenyl-(6-phenyl-2-pyridinyl)borane
CID 140742144
2-methyl-8-[5-methyl-4-(2-methyl-4-phenylnaphthalen-1-yl)-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 176779482
2-methyl-8-[4-(2-methyl-4-phenylnaphthalen-1-yl)-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 176779070
2-methyl-8-[4-(5-methylquinolin-6-yl)-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 176778917
8-[4-(3-fluorophenyl)-2-pyridinyl]-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 90121582
8-(4-benzyl-2-pyridinyl)-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 162707390
8-[4-(2,3-difluorophenyl)-2-pyridinyl]-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 90121594
2-methyl-8-[4-(3-propan-2-ylphenyl)-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 90121498

Frequently Asked Questions

What is the IUPAC name of 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine (CID 153444870) is 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine is Cc1ccc2c(n1)oc1c(-c3ncnc4cc(-c5ccccc5)oc34)cccc12.
What is the InChIKey of 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine?
The InChIKey is BOMZTQDHRAQXFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15N3O2/c1-14-10-11-17-16-8-5-9-18(22(16)29-24(17)27-14)21-23-19(25-13-26-21)12-20(28-23)15-6-3-2-4-7-15/h2-13H,1H3.
What are the key properties of 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine?
2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine has a molecular weight of 377.40 g/mol, XLogP of 6.16, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-8-(6-phenylfuro[3,2-d]pyrimidin-4-yl)-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 153444870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).