2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride

C16H20ClNO — CID 162317712

IUPAC2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride
SMILESCCc1ccccc1OCC(N)c1ccccc1.Cl
InChIInChI=1S/C16H19NO.ClH/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14;/h3-11,15H,2,12,17H2,1H3;1H
InChIKeyCMUOYXGNODPLLM-UHFFFAOYSA-N
MW277.80 g/mol
LogP3.75
Rot. Bonds5

About 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride

2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride (PubChem CID 162317712) has the molecular formula C16H20ClNO and a molecular weight of 277.80 g/mol. Its IUPAC name is 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride.

Molecular Properties

Compound Name2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride
PubChem CID162317712
Molecular FormulaC16H20ClNO
Molecular Weight277.80 g/mol
Exact Mass277.12
IUPAC Name2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride
SMILESCCc1ccccc1OCC(N)c1ccccc1.Cl
InChIInChI=1S/C16H19NO.ClH/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14;/h3-11,15H,2,12,17H2,1H3;1H
InChIKeyCMUOYXGNODPLLM-UHFFFAOYSA-N
XLogP3.75
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.80
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethylphenoxy)-1-(3-methoxyphenyl)ethanamine
CID 43364268
1-(3,4-dimethylphenyl)-2-(2-ethylphenoxy)ethanamine
CID 43364252
(1S)-2-(2-methylphenoxy)-1-phenylethanamine;hydrochloride
CID 164614673
3-(2-ethylphenoxy)-2-phenylpropan-1-amine
CID 112516482
2-(2-ethylphenoxy)-1-phenylethanol
CID 60731173
2-(2-ethylphenoxy)-1-(2-methylphenyl)ethanamine
CID 43364243
1-(1,3-benzodioxol-5-yl)-2-(2-ethylphenoxy)ethanamine
CID 43364260
1-(2,2-dimethoxyethoxy)-2-ethylbenzene
CID 66223177
2-(2-butan-2-ylphenoxy)-1-phenylethanamine
CID 43099395
2-(2-fluorophenoxy)-1-phenylethanamine
CID 16782769
(1S)-2-phenoxy-1-phenylethanamine;hydrochloride
CID 131882540
3-(2-ethylphenoxy)-2-methylpropanamide
CID 64765862

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride?
The IUPAC name of 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride (CID 162317712) is 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride.
What is the SMILES notation for 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride?
The canonical SMILES for 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride is CCc1ccccc1OCC(N)c1ccccc1.Cl.
What is the InChIKey of 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride?
The InChIKey is CMUOYXGNODPLLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO.ClH/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14;/h3-11,15H,2,12,17H2,1H3;1H.
What are the key properties of 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride?
2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride has a molecular weight of 277.80 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride is sourced from PubChem (CID 162317712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).