2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine

C13H21NO — CID 64868119

IUPAC2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine
SMILESCCc1ccccc1CCNCCOC
InChIInChI=1S/C13H21NO/c1-3-12-6-4-5-7-13(12)8-9-14-10-11-15-2/h4-7,14H,3,8-11H2,1-2H3
InChIKeyQWBVIJYWGQIEGM-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.03
Rot. Bonds7

About 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine

2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine (PubChem CID 64868119) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine.

Molecular Properties

Compound Name2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine
PubChem CID64868119
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine
SMILESCCc1ccccc1CCNCCOC
InChIInChI=1S/C13H21NO/c1-3-12-6-4-5-7-13(12)8-9-14-10-11-15-2/h4-7,14H,3,8-11H2,1-2H3
InChIKeyQWBVIJYWGQIEGM-UHFFFAOYSA-N
XLogP2.03
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)ethanamine
CID 62800794
2-[2-(2-methoxyethylamino)ethyl]benzonitrile
CID 107937029
3-(2-ethylphenoxy)-N-(2-methoxyethyl)propan-1-amine
CID 55093398
N-ethyl-2-[2-[[2-methoxyethyl(methyl)amino]methyl]phenyl]ethanamine
CID 115464004
N'-(2-ethyl-6-methylphenyl)-N-(2-methoxyethyl)ethane-1,2-diamine
CID 54809654
N-[2-[2-(3,4-diethylphenyl)ethoxy]ethyl]-2-methoxyethanamine
CID 115483390
3-(2-bromophenyl)-N-(2-methoxyethyl)propan-1-amine
CID 62603094
3-methoxy-N-[2-(2-methoxyphenyl)ethyl]propan-1-amine
CID 106261296
2-[3-(2-methoxyethylamino)propyl]aniline
CID 107274451
2-(2-bromo-3-nitrophenyl)-N-(2-methoxyethyl)ethanamine
CID 114048927
5-(3,4-diethylphenyl)-N-(2-methoxyethyl)-3-methylpentan-1-amine
CID 115483366
N-(2-methoxyethyl)-2-(4-phenylphenyl)ethanamine
CID 64866230

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine?
The IUPAC name of 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine (CID 64868119) is 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine.
What is the SMILES notation for 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine?
The canonical SMILES for 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine is CCc1ccccc1CCNCCOC.
What is the InChIKey of 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine?
The InChIKey is QWBVIJYWGQIEGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-3-12-6-4-5-7-13(12)8-9-14-10-11-15-2/h4-7,14H,3,8-11H2,1-2H3.
What are the key properties of 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine?
2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine has a molecular weight of 207.32 g/mol, XLogP of 2.03, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenyl)-N-(2-methoxyethyl)ethanamine is sourced from PubChem (CID 64868119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).