2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine

C18H30N2O — CID 61218981

IUPAC2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine
SMILESCCOC1CCN(C(CN)c2ccc(C(C)C)cc2)CC1
InChIInChI=1S/C18H30N2O/c1-4-21-17-9-11-20(12-10-17)18(13-19)16-7-5-15(6-8-16)14(2)3/h5-8,14,17-18H,4,9-13,19H2,1-3H3
InChIKeyHJMMZUKZSSKSIG-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.31
Rot. Bonds6

About 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine

2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine (PubChem CID 61218981) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine
PubChem CID61218981
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine
SMILESCCOC1CCN(C(CN)c2ccc(C(C)C)cc2)CC1
InChIInChI=1S/C18H30N2O/c1-4-21-17-9-11-20(12-10-17)18(13-19)16-7-5-15(6-8-16)14(2)3/h5-8,14,17-18H,4,9-13,19H2,1-3H3
InChIKeyHJMMZUKZSSKSIG-UHFFFAOYSA-N
XLogP3.31
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-bromofuran-2-yl)-2-(4-ethoxypiperidin-1-yl)ethanamine
CID 61219757
2-(4-bromophenyl)-2-(3-ethoxypiperidin-1-yl)ethanamine
CID 54985342
2-(3-ethoxypiperidin-1-yl)-2-(4-fluorophenyl)ethanamine
CID 54985150
2-(4-ethoxypiperidin-1-yl)-3-phenylbutan-1-amine
CID 61218423
2-(3,4-dimethylpyrrolidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine
CID 79188487
2-(3-chloro-4-methylphenyl)-2-(3-ethoxypiperidin-1-yl)ethanamine
CID 106817344
2-[3-(methoxymethyl)piperidin-1-yl]-2-(4-propan-2-ylphenyl)ethanamine
CID 106586372
N-[2-(4-ethoxypiperidin-1-yl)-2-phenylethyl]propan-1-amine
CID 62427479
2-(4-bromophenyl)-2-(4-ethylpiperidin-1-yl)ethanamine
CID 61421143
2-(4-ethoxyphenyl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 61224408
1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol
CID 55016646
2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine
CID 63465065

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine?
The IUPAC name of 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine (CID 61218981) is 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine.
What is the SMILES notation for 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine?
The canonical SMILES for 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine is CCOC1CCN(C(CN)c2ccc(C(C)C)cc2)CC1.
What is the InChIKey of 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine?
The InChIKey is HJMMZUKZSSKSIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-21-17-9-11-20(12-10-17)18(13-19)16-7-5-15(6-8-16)14(2)3/h5-8,14,17-18H,4,9-13,19H2,1-3H3.
What are the key properties of 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine?
2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine has a molecular weight of 290.45 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxypiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine is sourced from PubChem (CID 61218981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).