4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline

C23H17FN2O4 — CID 89208447

IUPAC4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline
SMILESCOc1cc2nccc(Oc3ccc(N=O)cc3F)c2cc1OCc1ccccc1
InChIInChI=1S/C23H17FN2O4/c1-28-22-13-19-17(12-23(22)29-14-15-5-3-2-4-6-15)20(9-10-25-19)30-21-8-7-16(26-27)11-18(21)24/h2-13H,14H2,1H3
InChIKeyXOLLADIQYHDXIL-UHFFFAOYSA-N
MW404.40 g/mol
LogP6.15
Rot. Bonds7

About 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline

4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline (PubChem CID 89208447) has the molecular formula C23H17FN2O4 and a molecular weight of 404.40 g/mol. Its IUPAC name is 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline.

Molecular Properties

Compound Name4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline
PubChem CID89208447
Molecular FormulaC23H17FN2O4
Molecular Weight404.40 g/mol
Exact Mass404.12
IUPAC Name4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline
SMILESCOc1cc2nccc(Oc3ccc(N=O)cc3F)c2cc1OCc1ccccc1
InChIInChI=1S/C23H17FN2O4/c1-28-22-13-19-17(12-23(22)29-14-15-5-3-2-4-6-15)20(9-10-25-19)30-21-8-7-16(26-27)11-18(21)24/h2-13H,14H2,1H3
InChIKeyXOLLADIQYHDXIL-UHFFFAOYSA-N
XLogP6.15
TPSA70.01 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.40
LogP ≤ 56.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline 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

azane;4-(2-fluorophenoxy)-6-methoxy-7-phenylmethoxyquinoline
CID 67265211
4-(2-fluoro-4-nitrosophenoxy)-6-methoxy-7-(piperidin-4-ylmethoxy)quinoline
CID 89303527
1-benzyl-4-[3-fluoro-4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]piperazine-2,5-dione
CID 58751816
3-[3-fluoro-4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]-4-hydroxy-1H-imidazol-2-one
CID 91145743
methyl 2-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxybenzoate
CID 175032455
6-methoxy-4-(2-methylquinolin-3-yl)oxy-7-phenylmethoxyquinoline
CID 23078517
1-N'-[3-fluoro-4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]-1-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
CID 170901391
N-[3-fluoro-4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]-N-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 69396264
4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluoro-N-(2-phenylethyl)benzenesulfonamide
CID 11271621
1-benzyl-1-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]imidazolidin-1-ium-2-one
CID 87237886
6-methoxy-4-[(5-nitro-2-pyridinyl)oxy]-7-phenylmethoxyquinoline
CID 68837215
N'-benzylsulfonyl-N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]-2-phenylethanimidamide
CID 162674405

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline?
The IUPAC name of 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline (CID 89208447) is 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline.
What is the SMILES notation for 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline?
The canonical SMILES for 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline is COc1cc2nccc(Oc3ccc(N=O)cc3F)c2cc1OCc1ccccc1.
What is the InChIKey of 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline?
The InChIKey is XOLLADIQYHDXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17FN2O4/c1-28-22-13-19-17(12-23(22)29-14-15-5-3-2-4-6-15)20(9-10-25-19)30-21-8-7-16(26-27)11-18(21)24/h2-13H,14H2,1H3.
What are the key properties of 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline?
4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline has a molecular weight of 404.40 g/mol, XLogP of 6.15, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-4-nitrosophenoxy)-7-methoxy-6-phenylmethoxyquinoline is sourced from PubChem (CID 89208447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).