2-(3-methoxy-4-methylphenyl)ethanamine

C10H15NO — CID 13015320

IUPAC2-(3-methoxy-4-methylphenyl)ethanamine
SMILESCOc1cc(CCN)ccc1C
InChIInChI=1S/C10H15NO/c1-8-3-4-9(5-6-11)7-10(8)12-2/h3-4,7H,5-6,11H2,1-2H3
InChIKeyPXSYKFKOKXYQRH-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.50
Rot. Bonds3

About 2-(3-methoxy-4-methylphenyl)ethanamine

2-(3-methoxy-4-methylphenyl)ethanamine (PubChem CID 13015320) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-(3-methoxy-4-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(3-methoxy-4-methylphenyl)ethanamine
PubChem CID13015320
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-(3-methoxy-4-methylphenyl)ethanamine
SMILESCOc1cc(CCN)ccc1C
InChIInChI=1S/C10H15NO/c1-8-3-4-9(5-6-11)7-10(8)12-2/h3-4,7H,5-6,11H2,1-2H3
InChIKeyPXSYKFKOKXYQRH-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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Related Compounds

2-(3,4-dimethoxyphenyl)ethanamine;hydroiodide
CID 46741035
[5-(2-aminoethyl)-2-methylphenoxy]methanetriamine
CID 163516444
4-(2-aminoethyl)-2-methoxyaniline;dihydrochloride
CID 122360118
2-[3-(3,4-dimethylphenyl)-4-methoxyphenyl]ethanamine
CID 82107025
4-(3-bromopropyl)-2-methoxy-1-methylbenzene
CID 18626504
2-[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-methoxyphenyl]ethanamine
CID 20992783
2-[3-[(2,5-dimethylphenoxy)methyl]-4-methoxyphenyl]ethanamine
CID 170868758
2-(3-methoxy-4-methylphenyl)ethyl acetate
CID 58508848
2-amino-N-[2-(3-methoxy-4-methylphenyl)ethyl]acetamide
CID 119326320
2-methoxy-4-(methoxymethyl)-1-methylbenzene
CID 91136887
2-[4-methoxy-3-(2-methylphenyl)phenyl]ethanamine
CID 82038847
2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine
CID 105410974

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-4-methylphenyl)ethanamine?
The IUPAC name of 2-(3-methoxy-4-methylphenyl)ethanamine (CID 13015320) is 2-(3-methoxy-4-methylphenyl)ethanamine.
What is the SMILES notation for 2-(3-methoxy-4-methylphenyl)ethanamine?
The canonical SMILES for 2-(3-methoxy-4-methylphenyl)ethanamine is COc1cc(CCN)ccc1C.
What is the InChIKey of 2-(3-methoxy-4-methylphenyl)ethanamine?
The InChIKey is PXSYKFKOKXYQRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-8-3-4-9(5-6-11)7-10(8)12-2/h3-4,7H,5-6,11H2,1-2H3.
What are the key properties of 2-(3-methoxy-4-methylphenyl)ethanamine?
2-(3-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-(3-methoxy-4-methylphenyl)ethanamine is sourced from PubChem (CID 13015320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).