4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine

C20H23N3O — CID 165414919

IUPAC4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine
SMILESCOc1c(C)cnc(CCc2nc(-c3ccccc3)cn2C)c1C
InChIInChI=1S/C20H23N3O/c1-14-12-21-17(15(2)20(14)24-4)10-11-19-22-18(13-23(19)3)16-8-6-5-7-9-16/h5-9,12-13H,10-11H2,1-4H3
InChIKeyJCOFREJWGMBVCW-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.89
Rot. Bonds5

About 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine

4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine (PubChem CID 165414919) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine.

Molecular Properties

Compound Name4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine
PubChem CID165414919
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine
SMILESCOc1c(C)cnc(CCc2nc(-c3ccccc3)cn2C)c1C
InChIInChI=1S/C20H23N3O/c1-14-12-21-17(15(2)20(14)24-4)10-11-19-22-18(13-23(19)3)16-8-6-5-7-9-16/h5-9,12-13H,10-11H2,1-4H3
InChIKeyJCOFREJWGMBVCW-UHFFFAOYSA-N
XLogP3.89
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine 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 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine?
The IUPAC name of 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine (CID 165414919) is 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine.
What is the SMILES notation for 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine?
The canonical SMILES for 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine is COc1c(C)cnc(CCc2nc(-c3ccccc3)cn2C)c1C.
What is the InChIKey of 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine?
The InChIKey is JCOFREJWGMBVCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c1-14-12-21-17(15(2)20(14)24-4)10-11-19-22-18(13-23(19)3)16-8-6-5-7-9-16/h5-9,12-13H,10-11H2,1-4H3.
What are the key properties of 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine?
4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine has a molecular weight of 321.42 g/mol, XLogP of 3.89, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3,5-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyridine is sourced from PubChem (CID 165414919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).