2-(2-methoxy-4-methylphenyl)ethanamine

C10H15NO — CID 15128233

IUPAC2-(2-methoxy-4-methylphenyl)ethanamine
SMILESCOc1cc(C)ccc1CCN
InChIInChI=1S/C10H15NO/c1-8-3-4-9(5-6-11)10(7-8)12-2/h3-4,7H,5-6,11H2,1-2H3
InChIKeyMJUPKSHVRMHWMF-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.50
Rot. Bonds3

About 2-(2-methoxy-4-methylphenyl)ethanamine

2-(2-methoxy-4-methylphenyl)ethanamine (PubChem CID 15128233) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-(2-methoxy-4-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2-methoxy-4-methylphenyl)ethanamine
PubChem CID15128233
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-(2-methoxy-4-methylphenyl)ethanamine
SMILESCOc1cc(C)ccc1CCN
InChIInChI=1S/C10H15NO/c1-8-3-4-9(5-6-11)10(7-8)12-2/h3-4,7H,5-6,11H2,1-2H3
InChIKeyMJUPKSHVRMHWMF-UHFFFAOYSA-N
XLogP1.50
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-4-methylphenyl)ethanamine?
The IUPAC name of 2-(2-methoxy-4-methylphenyl)ethanamine (CID 15128233) is 2-(2-methoxy-4-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2-methoxy-4-methylphenyl)ethanamine?
The canonical SMILES for 2-(2-methoxy-4-methylphenyl)ethanamine is COc1cc(C)ccc1CCN.
What is the InChIKey of 2-(2-methoxy-4-methylphenyl)ethanamine?
The InChIKey is MJUPKSHVRMHWMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-8-3-4-9(5-6-11)10(7-8)12-2/h3-4,7H,5-6,11H2,1-2H3.
What are the key properties of 2-(2-methoxy-4-methylphenyl)ethanamine?
2-(2-methoxy-4-methylphenyl)ethanamine has a molecular weight of 165.24 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4-methylphenyl)ethanamine is sourced from PubChem (CID 15128233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).