6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline

C23H20N2O2 — CID 161237861

IUPAC6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline
SMILESCOc1cc(Cc2ccc3ncc(-c4ccncc4)cc3c2)cc(OC)c1
InChIInChI=1S/C23H20N2O2/c1-26-21-11-17(12-22(14-21)27-2)9-16-3-4-23-19(10-16)13-20(15-25-23)18-5-7-24-8-6-18/h3-8,10-15H,9H2,1-2H3
InChIKeyUZPMSWHSHVGDRM-UHFFFAOYSA-N
MW356.43 g/mol
LogP4.90
Rot. Bonds5

About 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline

6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline (PubChem CID 161237861) has the molecular formula C23H20N2O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline.

Molecular Properties

Compound Name6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline
PubChem CID161237861
Molecular FormulaC23H20N2O2
Molecular Weight356.43 g/mol
Exact Mass356.15
IUPAC Name6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline
SMILESCOc1cc(Cc2ccc3ncc(-c4ccncc4)cc3c2)cc(OC)c1
InChIInChI=1S/C23H20N2O2/c1-26-21-11-17(12-22(14-21)27-2)9-16-3-4-23-19(10-16)13-20(15-25-23)18-5-7-24-8-6-18/h3-8,10-15H,9H2,1-2H3
InChIKeyUZPMSWHSHVGDRM-UHFFFAOYSA-N
XLogP4.90
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline 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

6-Methoxy-4-methylquinoline
CID 258761
1-Benzyl-6-methoxy-4-methylquinolinium chloride
CID 2834440
5,7-Dimethoxy-3-(4-pyridinyl)quinoline
CID 3139
5,6,7-Trimethoxy-3-pyridin-4-yl-quinoline
CID 9994707
6-Methoxy-3-pyridin-4-yl-quinoline
CID 10354094
1-Methyl-5-[1-(3,4,5-trimethoxyphenyl)ethyl]indole
CID 52914800
Quinoline, 4-(2,4,5-trimethoxystyryl)-
CID 5351198
3-(3,5-Dimethoxyphenyl)-1,6-naphthyridine-2,7-diamine
CID 5328996
7-(3,5-Dimethoxyphenyl)-1,6-naphthyridine
CID 44142284
3-Methoxy-5-(1,6-naphthyridin-7-yl)benzonitrile
CID 44434727
7-(3,5-Dimethoxyphenyl)-2-methyl-1,6-naphthyridine
CID 44434752
8-[[1-[[3,5-Diethoxy-4-(4-fluorophenyl)phenyl]methyl]piperidin-4-yl]methoxy]quinoline
CID 145993203

Frequently Asked Questions

What is the IUPAC name of 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline?
The IUPAC name of 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline (CID 161237861) is 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline.
What is the SMILES notation for 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline?
The canonical SMILES for 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline is COc1cc(Cc2ccc3ncc(-c4ccncc4)cc3c2)cc(OC)c1.
What is the InChIKey of 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline?
The InChIKey is UZPMSWHSHVGDRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2/c1-26-21-11-17(12-22(14-21)27-2)9-16-3-4-23-19(10-16)13-20(15-25-23)18-5-7-24-8-6-18/h3-8,10-15H,9H2,1-2H3.
What are the key properties of 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline?
6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline has a molecular weight of 356.43 g/mol, XLogP of 4.90, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3,5-dimethoxyphenyl)methyl]-3-pyridin-4-ylquinoline is sourced from PubChem (CID 161237861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).