3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine

C19H22N2O2 — CID 44516996

IUPAC3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine
SMILESCOc1ccc(Cc2cncc(C3=NCCCC3)c2)c(OC)c1
InChIInChI=1S/C19H22N2O2/c1-22-17-7-6-15(19(11-17)23-2)9-14-10-16(13-20-12-14)18-5-3-4-8-21-18/h6-7,10-13H,3-5,8-9H2,1-2H3
InChIKeyUYROGHAEDWPCLS-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.66
Rot. Bonds5

About 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine

3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine (PubChem CID 44516996) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine.

Molecular Properties

Compound Name3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine
PubChem CID44516996
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine
SMILESCOc1ccc(Cc2cncc(C3=NCCCC3)c2)c(OC)c1
InChIInChI=1S/C19H22N2O2/c1-22-17-7-6-15(19(11-17)23-2)9-14-10-16(13-20-12-14)18-5-3-4-8-21-18/h6-7,10-13H,3-5,8-9H2,1-2H3
InChIKeyUYROGHAEDWPCLS-UHFFFAOYSA-N
XLogP3.66
TPSA43.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine 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

3-[(4-methoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine
CID 44516998
2,4-dimethoxy-1-[(3-methoxyphenyl)methyl]benzene
CID 173405518
4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol
CID 91244154
3-(2,4-dimethoxyphenyl)-N-[(5-thiophen-3-yl-3-pyridinyl)methyl]propanamide
CID 90627889
(2,4-dimethoxyphenyl)methyl-(pyridin-3-ylmethyl)azanium
CID 5045085
1-(iodomethyl)-2,4-dimethoxybenzene
CID 91883521
1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-dimethoxybenzene
CID 54567492
4-methoxy-1-[(4-methoxyphenyl)methyl]-2-methylbenzene
CID 15654338
1-[(4-bromophenyl)methyl]-4-[(2,4-dimethoxyphenyl)methyl]piperazine
CID 1222780
4-[2-(2,4-dimethoxyphenyl)ethyl]aniline
CID 14256033
3-[(5E)-5-[(2,4-dimethoxyphenyl)methylidene]-3,4-dihydro-2H-pyridin-6-yl]pyridine;hydron;dichloride
CID 66618703
1-[(2,4-dimethoxyphenyl)methyl]-N-methylpiperidin-3-amine;hydrochloride
CID 75493797

Frequently Asked Questions

What is the IUPAC name of 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine?
The IUPAC name of 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine (CID 44516996) is 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine.
What is the SMILES notation for 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine?
The canonical SMILES for 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine is COc1ccc(Cc2cncc(C3=NCCCC3)c2)c(OC)c1.
What is the InChIKey of 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine?
The InChIKey is UYROGHAEDWPCLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-22-17-7-6-15(19(11-17)23-2)9-14-10-16(13-20-12-14)18-5-3-4-8-21-18/h6-7,10-13H,3-5,8-9H2,1-2H3.
What are the key properties of 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine?
3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine has a molecular weight of 310.40 g/mol, XLogP of 3.66, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,4-dimethoxyphenyl)methyl]-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine is sourced from PubChem (CID 44516996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).