[2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine

C16H19NO — CID 62309021

IUPAC[2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine
SMILESCc1ccc(CN)c(Oc2ccc(C)c(C)c2)c1
InChIInChI=1S/C16H19NO/c1-11-4-6-14(10-17)16(8-11)18-15-7-5-12(2)13(3)9-15/h4-9H,10,17H2,1-3H3
InChIKeyOAWAEMJHDUEJOJ-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.86
Rot. Bonds3

About [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine

[2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine (PubChem CID 62309021) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine.

Molecular Properties

Compound Name[2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine
PubChem CID62309021
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name[2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine
SMILESCc1ccc(CN)c(Oc2ccc(C)c(C)c2)c1
InChIInChI=1S/C16H19NO/c1-11-4-6-14(10-17)16(8-11)18-15-7-5-12(2)13(3)9-15/h4-9H,10,17H2,1-3H3
InChIKeyOAWAEMJHDUEJOJ-UHFFFAOYSA-N
XLogP3.86
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(3,4-dimethylphenoxy)-4-methylphenyl]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

[2-(2,5-dimethylphenoxy)-4-methylphenyl]methanamine
CID 62308844
[2-(4-fluorophenoxy)-4-methylphenyl]methanamine
CID 62306766
[4-(2-chloro-5-methylphenoxy)-2-methylphenyl]methanamine
CID 55038503
[2-(4-tert-butylphenoxy)-4-methylphenyl]methanamine
CID 63456891
[4-[2-(aminomethyl)-5-methylphenoxy]phenyl]methanol
CID 62306971
[3-(3,4-dimethylphenoxy)-4-pyridinyl]methanamine
CID 59112975
[2-bromo-4-(3,4-dimethylphenoxy)-3-fluorophenyl]methanamine
CID 107532595
[2-(4-fluoro-3-methylphenoxy)-5-methylphenyl]methanamine
CID 107926537
[5-bromo-2-(3,4-dimethylphenoxy)phenyl]methanamine
CID 114889855
[2-(2-methoxyphenoxy)-4-methylphenyl]methanamine
CID 62306948
[2-(4-chloro-3-methylphenoxy)-4-methoxyphenyl]methanamine
CID 81299924
2-(3,4-dimethylphenoxy)-4-methylbenzenecarbothioamide
CID 62301441

Frequently Asked Questions

What is the IUPAC name of [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine?
The IUPAC name of [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine (CID 62309021) is [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine.
What is the SMILES notation for [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine?
The canonical SMILES for [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine is Cc1ccc(CN)c(Oc2ccc(C)c(C)c2)c1.
What is the InChIKey of [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine?
The InChIKey is OAWAEMJHDUEJOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-11-4-6-14(10-17)16(8-11)18-15-7-5-12(2)13(3)9-15/h4-9H,10,17H2,1-3H3.
What are the key properties of [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine?
[2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine has a molecular weight of 241.33 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-dimethylphenoxy)-4-methylphenyl]methanamine is sourced from PubChem (CID 62309021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).