N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine

C16H21N3 — CID 105072688

IUPACN-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine
SMILESCCN(c1ccccc1C)c1cnccc1CNC
InChIInChI=1S/C16H21N3/c1-4-19(15-8-6-5-7-13(15)2)16-12-18-10-9-14(16)11-17-3/h5-10,12,17H,4,11H2,1-3H3
InChIKeyZMZQBJCFHQPLOR-UHFFFAOYSA-N
MW255.37 g/mol
LogP3.27
Rot. Bonds5

About N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine

N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine (PubChem CID 105072688) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine
PubChem CID105072688
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC NameN-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine
SMILESCCN(c1ccccc1C)c1cnccc1CNC
InChIInChI=1S/C16H21N3/c1-4-19(15-8-6-5-7-13(15)2)16-12-18-10-9-14(16)11-17-3/h5-10,12,17H,4,11H2,1-3H3
InChIKeyZMZQBJCFHQPLOR-UHFFFAOYSA-N
XLogP3.27
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine 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 N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine?
The IUPAC name of N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine (CID 105072688) is N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine.
What is the SMILES notation for N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine?
The canonical SMILES for N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine is CCN(c1ccccc1C)c1cnccc1CNC.
What is the InChIKey of N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine?
The InChIKey is ZMZQBJCFHQPLOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-4-19(15-8-6-5-7-13(15)2)16-12-18-10-9-14(16)11-17-3/h5-10,12,17H,4,11H2,1-3H3.
What are the key properties of N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine?
N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine has a molecular weight of 255.37 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine is sourced from PubChem (CID 105072688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).