2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine

C17H28N2O — CID 43584286

IUPAC2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine
SMILESCCOc1ccc(C(CN)N2CCCC(CC)C2)cc1
InChIInChI=1S/C17H28N2O/c1-3-14-6-5-11-19(13-14)17(12-18)15-7-9-16(10-8-15)20-4-2/h7-10,14,17H,3-6,11-13,18H2,1-2H3
InChIKeyQLKFSGVMDVUDDC-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.21
Rot. Bonds6

About 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine

2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine (PubChem CID 43584286) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine
PubChem CID43584286
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine
SMILESCCOc1ccc(C(CN)N2CCCC(CC)C2)cc1
InChIInChI=1S/C17H28N2O/c1-3-14-6-5-11-19(13-14)17(12-18)15-7-9-16(10-8-15)20-4-2/h7-10,14,17H,3-6,11-13,18H2,1-2H3
InChIKeyQLKFSGVMDVUDDC-UHFFFAOYSA-N
XLogP3.21
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-ethylpiperidin-1-yl)-2-(4-methoxyphenyl)ethanamine
CID 43584268
2-(4-ethoxyphenyl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 61224408
2-(3-ethylpiperidin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine
CID 114937023
2-(3-bromo-4-methoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine
CID 61036698
2-(3-ethylpiperidin-1-yl)-2-(3-methylphenyl)ethanamine
CID 43584386
2-(1,3-benzodioxol-5-yl)-2-(3-ethylpiperidin-1-yl)ethanamine
CID 43584359
2-[3-(methoxymethyl)piperidin-1-yl]-2-(4-propan-2-ylphenyl)ethanamine
CID 106586372
2-[4-(difluoromethyl)phenyl]-2-[3-(methoxymethyl)piperidin-1-yl]ethanamine
CID 106586267
2-(4-ethoxyphenyl)-2-(1,4-oxazepan-4-yl)ethanamine
CID 55152004
2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
CID 43584299
2-(2,3-dimethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine
CID 43584302
2-(3-ethoxypiperidin-1-yl)-2-(4-fluorophenyl)ethanamine
CID 54985150

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine?
The IUPAC name of 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine (CID 43584286) is 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine?
The canonical SMILES for 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine is CCOc1ccc(C(CN)N2CCCC(CC)C2)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine?
The InChIKey is QLKFSGVMDVUDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-3-14-6-5-11-19(13-14)17(12-18)15-7-9-16(10-8-15)20-4-2/h7-10,14,17H,3-6,11-13,18H2,1-2H3.
What are the key properties of 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine?
2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine has a molecular weight of 276.42 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 43584286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).