2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine

C16H20N2O2 — CID 60924306

IUPAC2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine
SMILESCNC(Cc1ccc(OC)c(OC)c1)c1cccnc1
InChIInChI=1S/C16H20N2O2/c1-17-14(13-5-4-8-18-11-13)9-12-6-7-15(19-2)16(10-12)20-3/h4-8,10-11,14,17H,9H2,1-3H3
InChIKeyGQTARFKTBUKTMR-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.60
Rot. Bonds6

About 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine

2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine (PubChem CID 60924306) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine
PubChem CID60924306
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine
SMILESCNC(Cc1ccc(OC)c(OC)c1)c1cccnc1
InChIInChI=1S/C16H20N2O2/c1-17-14(13-5-4-8-18-11-13)9-12-6-7-15(19-2)16(10-12)20-3/h4-8,10-11,14,17H,9H2,1-3H3
InChIKeyGQTARFKTBUKTMR-UHFFFAOYSA-N
XLogP2.60
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine 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

2-(3,4-dimethoxyphenyl)-N-methyl-1-(3-methylphenyl)ethanamine
CID 60864252
2-(4-iodophenyl)-N-methyl-1-pyridin-3-ylethanamine
CID 65477287
2-(3,4-dimethoxyphenyl)-N-methyl-1-(4-methylphenyl)ethanamine
CID 3070941
2-(3-chlorophenyl)-1-(3,4-dimethoxyphenyl)-N-methylethanamine
CID 60819659
1-(2-methoxy-5-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 62794931
(1R)-2-[[(1R)-1-(3,4-dimethoxyphenyl)-2-phenylethyl]amino]-1-pyridin-3-ylethanol
CID 22881914
N-methyl-1-pyridin-3-yl-2-thiophen-3-ylethanamine
CID 61077665
1-(3,4-dimethylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 62549735
2-(3,4-dimethoxyphenyl)-N-ethyl-1-pyrazin-2-ylethanamine
CID 63969018
N-methyl-1-(5-methyl-3-pyridinyl)-2-pyridin-3-ylethanamine
CID 113297193
N-methyl-1-pyridin-3-yl-1-(2,3,4-trimethoxyphenyl)methanamine
CID 43589047
(1S)-1-(3,4-dimethoxyphenyl)-N-(pyridin-3-ylmethyl)propan-1-amine
CID 948867

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine (CID 60924306) is 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine is CNC(Cc1ccc(OC)c(OC)c1)c1cccnc1.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine?
The InChIKey is GQTARFKTBUKTMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-17-14(13-5-4-8-18-11-13)9-12-6-7-15(19-2)16(10-12)20-3/h4-8,10-11,14,17H,9H2,1-3H3.
What are the key properties of 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine?
2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine has a molecular weight of 272.35 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-N-methyl-1-pyridin-3-ylethanamine is sourced from PubChem (CID 60924306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).