3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine

C19H15ClFNO — CID 86305091

IUPAC3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine
SMILESCOc1ncc(Cc2ccc(F)cc2)cc1-c1cccc(Cl)c1
InChIInChI=1S/C19H15ClFNO/c1-23-19-18(15-3-2-4-16(20)11-15)10-14(12-22-19)9-13-5-7-17(21)8-6-13/h2-8,10-12H,9H2,1H3
InChIKeyNPOUGRPJBAGGCM-UHFFFAOYSA-N
MW327.79 g/mol
LogP5.14
Rot. Bonds4

About 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine

3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine (PubChem CID 86305091) has the molecular formula C19H15ClFNO and a molecular weight of 327.79 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine.

Molecular Properties

Compound Name3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine
PubChem CID86305091
Molecular FormulaC19H15ClFNO
Molecular Weight327.79 g/mol
Exact Mass327.08
IUPAC Name3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine
SMILESCOc1ncc(Cc2ccc(F)cc2)cc1-c1cccc(Cl)c1
InChIInChI=1S/C19H15ClFNO/c1-23-19-18(15-3-2-4-16(20)11-15)10-14(12-22-19)9-13-5-7-17(21)8-6-13/h2-8,10-12H,9H2,1H3
InChIKeyNPOUGRPJBAGGCM-UHFFFAOYSA-N
XLogP5.14
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.79
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine?
The IUPAC name of 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine (CID 86305091) is 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine.
What is the SMILES notation for 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine?
The canonical SMILES for 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine is COc1ncc(Cc2ccc(F)cc2)cc1-c1cccc(Cl)c1.
What is the InChIKey of 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine?
The InChIKey is NPOUGRPJBAGGCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFNO/c1-23-19-18(15-3-2-4-16(20)11-15)10-14(12-22-19)9-13-5-7-17(21)8-6-13/h2-8,10-12H,9H2,1H3.
What are the key properties of 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine?
3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine has a molecular weight of 327.79 g/mol, XLogP of 5.14, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxypyridine is sourced from PubChem (CID 86305091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).