2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine

C16H26N2O — CID 83974398

IUPAC2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine
SMILESCCOc1ccccc1C(CN)C1CCN(C)CC1
InChIInChI=1S/C16H26N2O/c1-3-19-16-7-5-4-6-14(16)15(12-17)13-8-10-18(2)11-9-13/h4-7,13,15H,3,8-12,17H2,1-2H3
InChIKeyJFDOZJRPLFOADX-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.47
Rot. Bonds5

About 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine

2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine (PubChem CID 83974398) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine
PubChem CID83974398
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine
SMILESCCOc1ccccc1C(CN)C1CCN(C)CC1
InChIInChI=1S/C16H26N2O/c1-3-19-16-7-5-4-6-14(16)15(12-17)13-8-10-18(2)11-9-13/h4-7,13,15H,3,8-12,17H2,1-2H3
InChIKeyJFDOZJRPLFOADX-UHFFFAOYSA-N
XLogP2.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-4-yl]ethanamine
CID 83974409
[4-[2-amino-1-(2-ethoxyphenyl)ethyl]cyclohexyl]methanol
CID 83974412
2-(1-methylpiperidin-4-yl)-2-(2,3,4-trimethylphenyl)ethanamine
CID 116825043
2-(2-ethoxy-5-fluorophenyl)-2-(1-propan-2-ylpiperidin-4-yl)ethanamine
CID 83974722
2-(2-ethoxyphenyl)-2-fluoroethanamine
CID 112562684
2-[4-[2-amino-1-(5-chloro-2-ethoxyphenyl)ethyl]piperidin-1-yl]ethanol
CID 83974682
2-(5-chloro-2-ethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-4-yl]ethanamine
CID 83974680
(2R)-2-(2-ethoxyphenyl)-2-piperidin-1-ylethanamine
CID 93489676
2-cyclohexyl-2-(2-ethoxy-5-methylphenyl)ethanamine
CID 83974493
2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-(2-ethoxyphenyl)ethanamine
CID 62884895
1-(2-ethoxyphenyl)-2-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]ethanol
CID 63273824
1-[1-(2-ethoxyphenyl)ethyl]piperidin-4-amine
CID 43130865

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine?
The IUPAC name of 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine (CID 83974398) is 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine.
What is the SMILES notation for 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine?
The canonical SMILES for 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine is CCOc1ccccc1C(CN)C1CCN(C)CC1.
What is the InChIKey of 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine?
The InChIKey is JFDOZJRPLFOADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-19-16-7-5-4-6-14(16)15(12-17)13-8-10-18(2)11-9-13/h4-7,13,15H,3,8-12,17H2,1-2H3.
What are the key properties of 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine?
2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine has a molecular weight of 262.40 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-2-(1-methylpiperidin-4-yl)ethanamine is sourced from PubChem (CID 83974398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).