4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline

C16H20N2O — CID 116952129

IUPAC4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline
SMILESCNc1ccc(C(NC)c2ccccc2OC)cc1
InChIInChI=1S/C16H20N2O/c1-17-13-10-8-12(9-11-13)16(18-2)14-6-4-5-7-15(14)19-3/h4-11,16-18H,1-3H3
InChIKeyGPWNAHPQGWFQLR-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.05
Rot. Bonds5

About 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline

4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline (PubChem CID 116952129) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline.

Molecular Properties

Compound Name4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline
PubChem CID116952129
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline
SMILESCNc1ccc(C(NC)c2ccccc2OC)cc1
InChIInChI=1S/C16H20N2O/c1-17-13-10-8-12(9-11-13)16(18-2)14-6-4-5-7-15(14)19-3/h4-11,16-18H,1-3H3
InChIKeyGPWNAHPQGWFQLR-UHFFFAOYSA-N
XLogP3.05
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline 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

1-(2-methoxyphenyl)-N-methyl-1-pyridin-4-ylmethanamine
CID 60819715
1-[4-(2-methoxyethyl)phenyl]-1-(2-methoxyphenyl)-N-methylmethanamine
CID 43482394
1-(3-chloro-4-methoxyphenyl)-1-(2-ethoxyphenyl)-N-methylmethanamine
CID 43480963
1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43480670
N-methyl-4-[methylamino-(2,4,5-trimethylphenyl)methyl]aniline
CID 116952114
1-(2-fluoro-3-methoxyphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 82807584
1-(2-fluoro-3-methoxyphenyl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 82808523
1-[2-(difluoromethoxy)phenyl]-1-(4-fluorophenyl)-N-methylmethanamine
CID 43481244
1-(2-ethoxyphenyl)-1-(3-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 43487683
1-(2-methoxyphenyl)-N,N'-dimethylmethanediamine
CID 116954416
1-(2-methoxyphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43483471
1-[2-(2-methoxyethoxy)phenyl]-N-methyl-1-(4-methylphenyl)methanamine
CID 104659836

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline?
The IUPAC name of 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline (CID 116952129) is 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline.
What is the SMILES notation for 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline?
The canonical SMILES for 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline is CNc1ccc(C(NC)c2ccccc2OC)cc1.
What is the InChIKey of 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline?
The InChIKey is GPWNAHPQGWFQLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-17-13-10-8-12(9-11-13)16(18-2)14-6-4-5-7-15(14)19-3/h4-11,16-18H,1-3H3.
What are the key properties of 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline?
4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline has a molecular weight of 256.35 g/mol, XLogP of 3.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenyl)-(methylamino)methyl]-N-methylaniline is sourced from PubChem (CID 116952129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).