[2-(2,4-dimethylphenoxy)phenyl]methanamine

C15H17NO — CID 19627395

IUPAC[2-(2,4-dimethylphenoxy)phenyl]methanamine
SMILESCc1ccc(Oc2ccccc2CN)c(C)c1
InChIInChI=1S/C15H17NO/c1-11-7-8-14(12(2)9-11)17-15-6-4-3-5-13(15)10-16/h3-9H,10,16H2,1-2H3
InChIKeyHAELJSGLPKZHNX-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.55
Rot. Bonds3

About [2-(2,4-dimethylphenoxy)phenyl]methanamine

[2-(2,4-dimethylphenoxy)phenyl]methanamine (PubChem CID 19627395) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is [2-(2,4-dimethylphenoxy)phenyl]methanamine.

Molecular Properties

Compound Name[2-(2,4-dimethylphenoxy)phenyl]methanamine
PubChem CID19627395
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name[2-(2,4-dimethylphenoxy)phenyl]methanamine
SMILESCc1ccc(Oc2ccccc2CN)c(C)c1
InChIInChI=1S/C15H17NO/c1-11-7-8-14(12(2)9-11)17-15-6-4-3-5-13(15)10-16/h3-9H,10,16H2,1-2H3
InChIKeyHAELJSGLPKZHNX-UHFFFAOYSA-N
XLogP3.55
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2,4-dimethylphenoxy)-5-fluorophenyl]methanamine
CID 43314141
2-[2-[2-(aminomethyl)-4-methylphenoxy]phenyl]ethanol
CID 107926570
[2-(2-chlorophenoxy)-5-methylphenyl]methanamine
CID 107926487
[2-(4-tert-butyl-2-methylphenoxy)-4-methylphenyl]methanamine
CID 63456905
3-(aminomethyl)-4-(2-methylphenoxy)aniline
CID 174383964
[2-(2-methoxyphenoxy)-4-methylphenyl]methanamine
CID 62306948
2-(2,4-dimethylphenoxy)phenol
CID 91665530
[2-(5-methyl-2-nitrophenoxy)phenyl]methanamine
CID 54915748
[2-(2,5-dimethylphenoxy)-4-methylphenyl]methanamine
CID 62308844
[5-bromo-2-(4-bromo-2-methylphenoxy)phenyl]methanamine
CID 114889929
[3-bromo-4-(2,4-dimethylphenoxy)phenyl]methanamine
CID 82797229
[2-(2,4-difluorophenoxy)-5-methylphenyl]methanamine
CID 114016683

Frequently Asked Questions

What is the IUPAC name of [2-(2,4-dimethylphenoxy)phenyl]methanamine?
The IUPAC name of [2-(2,4-dimethylphenoxy)phenyl]methanamine (CID 19627395) is [2-(2,4-dimethylphenoxy)phenyl]methanamine.
What is the SMILES notation for [2-(2,4-dimethylphenoxy)phenyl]methanamine?
The canonical SMILES for [2-(2,4-dimethylphenoxy)phenyl]methanamine is Cc1ccc(Oc2ccccc2CN)c(C)c1.
What is the InChIKey of [2-(2,4-dimethylphenoxy)phenyl]methanamine?
The InChIKey is HAELJSGLPKZHNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-11-7-8-14(12(2)9-11)17-15-6-4-3-5-13(15)10-16/h3-9H,10,16H2,1-2H3.
What are the key properties of [2-(2,4-dimethylphenoxy)phenyl]methanamine?
[2-(2,4-dimethylphenoxy)phenyl]methanamine has a molecular weight of 227.31 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4-dimethylphenoxy)phenyl]methanamine is sourced from PubChem (CID 19627395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).