8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine

C24H17FN2O — CID 90138440

IUPAC8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(n1)oc1c(-c3ncccc3-c3ccccc3F)c(C)ccc12
InChIInChI=1S/C24H17FN2O/c1-14-9-11-18-19-12-10-15(2)27-24(19)28-23(18)21(14)22-17(7-5-13-26-22)16-6-3-4-8-20(16)25/h3-13H,1-2H3
InChIKeyURAGMGKAOLUHCC-UHFFFAOYSA-N
MW368.41 g/mol
LogP6.47
Rot. Bonds2

About 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine

8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine (PubChem CID 90138440) has the molecular formula C24H17FN2O and a molecular weight of 368.41 g/mol. Its IUPAC name is 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
PubChem CID90138440
Molecular FormulaC24H17FN2O
Molecular Weight368.41 g/mol
Exact Mass368.13
IUPAC Name8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(n1)oc1c(-c3ncccc3-c3ccccc3F)c(C)ccc12
InChIInChI=1S/C24H17FN2O/c1-14-9-11-18-19-12-10-15(2)27-24(19)28-23(18)21(14)22-17(7-5-13-26-22)16-6-3-4-8-20(16)25/h3-13H,1-2H3
InChIKeyURAGMGKAOLUHCC-UHFFFAOYSA-N
XLogP6.47
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.41
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine with MolForge

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Related Compounds

(-)-Dimethyl-{2-[3-((R)-1-pyridin-2-yl-ethyl)-benzofuran-2-yl]-ethyl}-amine
CID 44247935
N-(3-fluorophenyl)-4-pyridin-3-yl-1-benzofuran-7-carboxamide
CID 49789629
N-(naphthalen-1-ylmethyl)benzofuro[2,3-b]pyridin-4-amine
CID 52948511
N-dibenzofuran-3-yl-2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]acetamide
CID 127028963
N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]dibenzofuran-3-carboxamide
CID 134142008
N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]dibenzofuran-3-carboxamide
CID 134150726
N-(dibenzo[b,d]furan-3-ylmethyl)-4-(pyrazin-2-yl)benzamide
CID 134156571
5,11-Dimethyl[1]benzofuro[3,2-g]isoquinoline
CID 272112
[4-(Pyridin-2-ylmethyl)piperazin-1-yl]-(3,6,7-trimethyl-1-benzofuran-2-yl)methanone
CID 24817440
1-Dibenzofuran-4-ylisoquinoline
CID 459769
US20240158379, Example 31
CID 135163579
2-(Dibenzo[b,d]furan-4-yl)pyridine
CID 59500175

Frequently Asked Questions

What is the IUPAC name of 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine (CID 90138440) is 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine is Cc1ccc2c(n1)oc1c(-c3ncccc3-c3ccccc3F)c(C)ccc12.
What is the InChIKey of 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The InChIKey is URAGMGKAOLUHCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17FN2O/c1-14-9-11-18-19-12-10-15(2)27-24(19)28-23(18)21(14)22-17(7-5-13-26-22)16-6-3-4-8-20(16)25/h3-13H,1-2H3.
What are the key properties of 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine has a molecular weight of 368.41 g/mol, XLogP of 6.47, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[3-(2-fluorophenyl)-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 90138440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).