N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine

C15H18N2 — CID 116824646

IUPACN-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine
SMILESCNCC(c1cccc(C)c1)c1ccccn1
InChIInChI=1S/C15H18N2/c1-12-6-5-7-13(10-12)14(11-16-2)15-8-3-4-9-17-15/h3-10,14,16H,11H2,1-2H3
InChIKeyPJJZSHBIXKWLIK-UHFFFAOYSA-N
MW226.32 g/mol
LogP2.74
Rot. Bonds4

About N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine

N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine (PubChem CID 116824646) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine
PubChem CID116824646
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC NameN-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine
SMILESCNCC(c1cccc(C)c1)c1ccccn1
InChIInChI=1S/C15H18N2/c1-12-6-5-7-13(10-12)14(11-16-2)15-8-3-4-9-17-15/h3-10,14,16H,11H2,1-2H3
InChIKeyPJJZSHBIXKWLIK-UHFFFAOYSA-N
XLogP2.74
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine 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-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine?
The IUPAC name of N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine (CID 116824646) is N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine.
What is the SMILES notation for N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine?
The canonical SMILES for N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine is CNCC(c1cccc(C)c1)c1ccccn1.
What is the InChIKey of N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine?
The InChIKey is PJJZSHBIXKWLIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-12-6-5-7-13(10-12)14(11-16-2)15-8-3-4-9-17-15/h3-10,14,16H,11H2,1-2H3.
What are the key properties of N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine?
N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine has a molecular weight of 226.32 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-methylphenyl)-2-pyridin-2-ylethanamine is sourced from PubChem (CID 116824646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).