8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline

C24H16FNO — CID 134956522

IUPAC8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline
SMILESFc1ccc([C@H](c2ccc3occc3c2)c2cccc3cccnc23)cc1
InChIInChI=1S/C24H16FNO/c25-20-9-6-16(7-10-20)23(19-8-11-22-18(15-19)12-14-27-22)21-5-1-3-17-4-2-13-26-24(17)21/h1-15,23H/t23-/m1/s1
InChIKeyHRFYUAZHDFKNNF-HSZRJFAPSA-N
MW353.40 g/mol
LogP6.30
Rot. Bonds3

About 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline

8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline (PubChem CID 134956522) has the molecular formula C24H16FNO and a molecular weight of 353.40 g/mol. Its IUPAC name is 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline.

Molecular Properties

Compound Name8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline
PubChem CID134956522
Molecular FormulaC24H16FNO
Molecular Weight353.40 g/mol
Exact Mass353.12
IUPAC Name8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline
SMILESFc1ccc([C@H](c2ccc3occc3c2)c2cccc3cccnc23)cc1
InChIInChI=1S/C24H16FNO/c25-20-9-6-16(7-10-20)23(19-8-11-22-18(15-19)12-14-27-22)21-5-1-3-17-4-2-13-26-24(17)21/h1-15,23H/t23-/m1/s1
InChIKeyHRFYUAZHDFKNNF-HSZRJFAPSA-N
XLogP6.30
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.40
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline 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

3-Methyl quinoline, 8b
CID 44472985
1-{4-Methoxy-3-[(8-quinolinyloxy)methyl]phenyl}ethanone
CID 973526
3-(Benzofuran-2-ylmethylene)anabaseine
CID 10338609
3-(1-(2-(5-fluorobenzofuran-3-yl)ethyl)-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
CID 11164277
3-(1-(2-(benzofuran-3-yl)ethyl)-1,2,3,6-tetrahydropyridin-4-yl)-5-fluoro-1H-indole
CID 11245340
8-{4-[2-(1-Benzofuran-3-yl)ethyl]-1-piperazinyl}-6-fluoroquinoline
CID 11383270
3-(1-(2-(benzofuran-3-yl)ethyl)-1,2,3,6-tetrahydropyridin-4-yl)-6-fluoro-1H-indole
CID 11428376
Methanone, (4-ethoxy-1-naphthalenyl)(1-pentyl-1H-indol-3-yl)-
CID 45267043
(4-ethoxynaphthalen-1-yl)(1-propyl-1H-indol-3-yl)methanone
CID 45270408
1-[4-[4-(4-Fluorophenyl)piperazin-1-yl]butyl]-3-(furan-3-yl)indole
CID 56640868
4-(Benzofuran-5-yl)pyridine
CID 69909895
[3-(5H-chromeno[4,3-b]pyridin-3-yl)-5-methyl-1-benzofuran-2-yl](phenyl)methanone
CID 1717478

Frequently Asked Questions

What is the IUPAC name of 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline?
The IUPAC name of 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline (CID 134956522) is 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline.
What is the SMILES notation for 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline?
The canonical SMILES for 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline is Fc1ccc([C@H](c2ccc3occc3c2)c2cccc3cccnc23)cc1.
What is the InChIKey of 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline?
The InChIKey is HRFYUAZHDFKNNF-HSZRJFAPSA-N. The full InChI is InChI=1S/C24H16FNO/c25-20-9-6-16(7-10-20)23(19-8-11-22-18(15-19)12-14-27-22)21-5-1-3-17-4-2-13-26-24(17)21/h1-15,23H/t23-/m1/s1.
What are the key properties of 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline?
8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline has a molecular weight of 353.40 g/mol, XLogP of 6.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline is sourced from PubChem (CID 134956522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).