4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine

C23H18FN3O2 — CID 102169168

IUPAC4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine
SMILESCOc1ccc(-c2nccc(-c3ccc(F)nc3)c2-c2ccc(OC)nc2)cc1
InChIInChI=1S/C23H18FN3O2/c1-28-18-7-3-15(4-8-18)23-22(17-6-10-21(29-2)27-14-17)19(11-12-25-23)16-5-9-20(24)26-13-16/h3-14H,1-2H3
InChIKeyCGFAKKNNMLTZQH-UHFFFAOYSA-N
MW387.41 g/mol
LogP5.03
Rot. Bonds5

About 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine

4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine (PubChem CID 102169168) has the molecular formula C23H18FN3O2 and a molecular weight of 387.41 g/mol. Its IUPAC name is 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine.

Molecular Properties

Compound Name4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine
PubChem CID102169168
Molecular FormulaC23H18FN3O2
Molecular Weight387.41 g/mol
Exact Mass387.14
IUPAC Name4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine
SMILESCOc1ccc(-c2nccc(-c3ccc(F)nc3)c2-c2ccc(OC)nc2)cc1
InChIInChI=1S/C23H18FN3O2/c1-28-18-7-3-15(4-8-18)23-22(17-6-10-21(29-2)27-14-17)19(11-12-25-23)16-5-9-20(24)26-13-16/h3-14H,1-2H3
InChIKeyCGFAKKNNMLTZQH-UHFFFAOYSA-N
XLogP5.03
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.41
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine with MolForge

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Related Compounds

Papaverine
CID 4680
6-Methoxy-3-pyridin-4-yl-quinoline
CID 10354094
7-Methoxy-3-pyridin-4-yl-quinoline
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Pseudopalmatine
CID 644002
Pyridine, 2-(4-ethoxyphenyl)-5-pentyl-
CID 3126242
6-(4-Heptoxyphenyl)-3-pyridinecarbonitrile
CID 3126290
4-(4-Methoxyphenyl)-2-methylpyridine
CID 23371780
6,7-Dimethoxy-1-[(4-methoxyphenyl)methyl]isoquinoline
CID 371187
2-(4-Methoxyphenyl)-4,6-diphenylpyridine
CID 1719430
2-Methyl-3-({[3'-(Piperidin-4-Yl)[1,1'-Biphenyl]-4-Yl]oxy}methyl)pyridine
CID 129900135
(4r)-4-[3-(2-Fluoropyridin-3-Yl)phenyl]-4-(4-Methoxyphenyl)-4,5-Dihydro-1,3-Oxazol-2-Amine
CID 44193304
2-(2-Fluorophenyl)-5-[(5-methoxy-3-pyridinyl)methyl]pyridine
CID 145981780

Frequently Asked Questions

What is the IUPAC name of 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine?
The IUPAC name of 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine (CID 102169168) is 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine.
What is the SMILES notation for 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine?
The canonical SMILES for 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine is COc1ccc(-c2nccc(-c3ccc(F)nc3)c2-c2ccc(OC)nc2)cc1.
What is the InChIKey of 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine?
The InChIKey is CGFAKKNNMLTZQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN3O2/c1-28-18-7-3-15(4-8-18)23-22(17-6-10-21(29-2)27-14-17)19(11-12-25-23)16-5-9-20(24)26-13-16/h3-14H,1-2H3.
What are the key properties of 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine?
4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine has a molecular weight of 387.41 g/mol, XLogP of 5.03, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-fluoro-3-pyridinyl)-2-(4-methoxyphenyl)-3-(6-methoxy-3-pyridinyl)pyridine is sourced from PubChem (CID 102169168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).