2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride

C10H16ClNO2 — CID 19749083

IUPAC2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride
SMILESCNCCOc1ccccc1OC.Cl
InChIInChI=1S/C10H15NO2.ClH/c1-11-7-8-13-10-6-4-3-5-9(10)12-2;/h3-6,11H,7-8H2,1-2H3;1H
InChIKeyCGXBHZFBZQODPL-UHFFFAOYSA-N
MW217.70 g/mol
LogP1.72
Rot. Bonds5

About 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride

2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride (PubChem CID 19749083) has the molecular formula C10H16ClNO2 and a molecular weight of 217.70 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride
PubChem CID19749083
Molecular FormulaC10H16ClNO2
Molecular Weight217.70 g/mol
Exact Mass217.09
IUPAC Name2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride
SMILESCNCCOc1ccccc1OC.Cl
InChIInChI=1S/C10H15NO2.ClH/c1-11-7-8-13-10-6-4-3-5-9(10)12-2;/h3-6,11H,7-8H2,1-2H3;1H
InChIKeyCGXBHZFBZQODPL-UHFFFAOYSA-N
XLogP1.72
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.70
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-methyl-2-(2-methylphenoxy)ethanamine;hydrochloride
CID 17178031
2-(2-ethylphenoxy)-N-methylethanamine;hydrochloride
CID 44665206
N-[2-(2-methoxyphenoxy)ethyl]-2-methylpropan-1-amine;hydrochloride
CID 117067322
1-methoxy-2-[12-(2-methoxyphenoxy)dodecoxy]benzene
CID 134880850
1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene
CID 78767785
1-methoxy-N-[2-(2-methoxyphenoxy)ethyl]propan-2-amine
CID 62572002
N-[2-(2-methoxyphenoxy)ethyl]-2-methylaniline
CID 62570750
1,2-dimethoxybenzene;dihydrochloride
CID 19834650
4-butoxy-N-[2-(2-methoxyphenoxy)ethyl]aniline
CID 54799245
2-(2-benzylphenoxy)-N-methylethanamine
CID 12660328
N-[2-(2-methoxyphenoxy)ethyl]hexadecan-1-amine
CID 54796021
methyl 2-[2-[2-(methylamino)ethoxy]phenyl]acetate
CID 117054245

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride?
The IUPAC name of 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride (CID 19749083) is 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride is CNCCOc1ccccc1OC.Cl.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride?
The InChIKey is CGXBHZFBZQODPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2.ClH/c1-11-7-8-13-10-6-4-3-5-9(10)12-2;/h3-6,11H,7-8H2,1-2H3;1H.
What are the key properties of 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride?
2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride has a molecular weight of 217.70 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride is sourced from PubChem (CID 19749083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).