[4-methyl-3-(2-phenylethyl)phenyl]methanamine

C16H19N — CID 134425806

IUPAC[4-methyl-3-(2-phenylethyl)phenyl]methanamine
SMILESCc1ccc(CN)cc1CCc1ccccc1
InChIInChI=1S/C16H19N/c1-13-7-8-15(12-17)11-16(13)10-9-14-5-3-2-4-6-14/h2-8,11H,9-10,12,17H2,1H3
InChIKeyODOGWWQOUIKSKM-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.24
Rot. Bonds4

About [4-methyl-3-(2-phenylethyl)phenyl]methanamine

[4-methyl-3-(2-phenylethyl)phenyl]methanamine (PubChem CID 134425806) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is [4-methyl-3-(2-phenylethyl)phenyl]methanamine.

Molecular Properties

Compound Name[4-methyl-3-(2-phenylethyl)phenyl]methanamine
PubChem CID134425806
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name[4-methyl-3-(2-phenylethyl)phenyl]methanamine
SMILESCc1ccc(CN)cc1CCc1ccccc1
InChIInChI=1S/C16H19N/c1-13-7-8-15(12-17)11-16(13)10-9-14-5-3-2-4-6-14/h2-8,11H,9-10,12,17H2,1H3
InChIKeyODOGWWQOUIKSKM-UHFFFAOYSA-N
XLogP3.24
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [4-methyl-3-(2-phenylethyl)phenyl]methanamine 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-methyl-2-(2-phenylethyl)-4-propan-2-ylbenzene
CID 142112281
[4-methyl-3-(2-phenylethyl)phenyl]-oxido-oxo-sulfanylidene-λ6-sulfane
CID 19596037
[4-methyl-3-(4-phenylphenyl)phenyl]methanamine
CID 105408962
N-[[3-(aminomethyl)phenyl]methyl]-2-(2,5-dimethylphenyl)ethanamine
CID 115213050
2-[4-(2-phenylethyl)phenyl]ethanamine
CID 15036636
2,4-dimethyl-1-(2-phenylethyl)benzene;gold
CID 173364905
2-ethyl-4-[2-(3-ethyl-4-methylphenyl)ethyl]-1-methylbenzene
CID 123325932
phenylmethanamine
CID 19864074
[3,5-dimethyl-4-(2-phenylethoxy)phenyl]methanamine
CID 28967110
benzene;2-phenylethylbenzene
CID 18982764
2-(2-methyl-5-phenylphenyl)ethanamine
CID 115027519
4-fluoro-2-methyl-1-(2-phenylethyl)benzene
CID 90778447

Frequently Asked Questions

What is the IUPAC name of [4-methyl-3-(2-phenylethyl)phenyl]methanamine?
The IUPAC name of [4-methyl-3-(2-phenylethyl)phenyl]methanamine (CID 134425806) is [4-methyl-3-(2-phenylethyl)phenyl]methanamine.
What is the SMILES notation for [4-methyl-3-(2-phenylethyl)phenyl]methanamine?
The canonical SMILES for [4-methyl-3-(2-phenylethyl)phenyl]methanamine is Cc1ccc(CN)cc1CCc1ccccc1.
What is the InChIKey of [4-methyl-3-(2-phenylethyl)phenyl]methanamine?
The InChIKey is ODOGWWQOUIKSKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-13-7-8-15(12-17)11-16(13)10-9-14-5-3-2-4-6-14/h2-8,11H,9-10,12,17H2,1H3.
What are the key properties of [4-methyl-3-(2-phenylethyl)phenyl]methanamine?
[4-methyl-3-(2-phenylethyl)phenyl]methanamine has a molecular weight of 225.33 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-3-(2-phenylethyl)phenyl]methanamine is sourced from PubChem (CID 134425806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).