2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline

C25H13F2NO — CID 134833194

IUPAC2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline
SMILESFc1ccc(C#Cc2cc3cc(-c4ccc(F)cc4)oc3c3ncccc23)cc1
InChIInChI=1S/C25H13F2NO/c26-20-9-4-16(5-10-20)3-6-18-14-19-15-23(17-7-11-21(27)12-8-17)29-25(19)24-22(18)2-1-13-28-24/h1-2,4-5,7-15H
InChIKeyWSGRGJLZLQXUFV-UHFFFAOYSA-N
MW381.38 g/mol
LogP6.33
Rot. Bonds1

About 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline

2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline (PubChem CID 134833194) has the molecular formula C25H13F2NO and a molecular weight of 381.38 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline
PubChem CID134833194
Molecular FormulaC25H13F2NO
Molecular Weight381.38 g/mol
Exact Mass381.10
IUPAC Name2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline
SMILESFc1ccc(C#Cc2cc3cc(-c4ccc(F)cc4)oc3c3ncccc23)cc1
InChIInChI=1S/C25H13F2NO/c26-20-9-4-16(5-10-20)3-6-18-14-19-15-23(17-7-11-21(27)12-8-17)29-25(19)24-22(18)2-1-13-28-24/h1-2,4-5,7-15H
InChIKeyWSGRGJLZLQXUFV-UHFFFAOYSA-N
XLogP6.33
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.38
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]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

2-(4-Methylquinolin-6-yl)-1,3-benzoxazole
CID 2421435
16-Amino-15-methoxy-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13,15-octaen-8-one
CID 11832657
N-[(8-methoxy-5-quinolinyl)methyl]-N,2-dimethyl-1-benzofuran-5-carboxamide
CID 72890574
2-(1-Benzofuran-2-yl)-4-phenylquinoline
CID 2457742
Benzofuro[2,3-g]isoquinoline
CID 268021
5-Chloro-2-(4-fluorophenyl)furo[3,2-h]quinoline
CID 102172084
5-Chloro-2-(2-fluorophenyl)furo[3,2-h]quinoline
CID 102172085
2-(4-Fluorophenyl)-5-nitrofuro[3,2-h]quinoline
CID 102172088
2-(2-Fluorophenyl)-5-nitrofuro[3,2-h]quinoline
CID 102172089
8-[(R)-1-benzofuran-5-yl-(4-fluorophenyl)methyl]quinoline
CID 134956522
Indolo[6,7-d]benzo[b]furan
CID 13438851
5-(9,9-Dimethyl-9h-fluoren-2-yl)-2-(quinolin-6-yl)benzo[d]oxazole
CID 90256961

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline?
The IUPAC name of 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline (CID 134833194) is 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline.
What is the SMILES notation for 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline?
The canonical SMILES for 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline is Fc1ccc(C#Cc2cc3cc(-c4ccc(F)cc4)oc3c3ncccc23)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline?
The InChIKey is WSGRGJLZLQXUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H13F2NO/c26-20-9-4-16(5-10-20)3-6-18-14-19-15-23(17-7-11-21(27)12-8-17)29-25(19)24-22(18)2-1-13-28-24/h1-2,4-5,7-15H.
What are the key properties of 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline?
2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline has a molecular weight of 381.38 g/mol, XLogP of 6.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethynyl]furo[3,2-h]quinoline is sourced from PubChem (CID 134833194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).