1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine

C18H30N2O — CID 115994916

IUPAC1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine
SMILESCCNC(CC)c1ccccc1N1CCC(OCC)CC1
InChIInChI=1S/C18H30N2O/c1-4-17(19-5-2)16-9-7-8-10-18(16)20-13-11-15(12-14-20)21-6-3/h7-10,15,17,19H,4-6,11-14H2,1-3H3
InChIKeyHYOCODPYQSKURA-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.75
Rot. Bonds7

About 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine

1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine (PubChem CID 115994916) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine.

Molecular Properties

Compound Name1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine
PubChem CID115994916
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine
SMILESCCNC(CC)c1ccccc1N1CCC(OCC)CC1
InChIInChI=1S/C18H30N2O/c1-4-17(19-5-2)16-9-7-8-10-18(16)20-13-11-15(12-14-20)21-6-3/h7-10,15,17,19H,4-6,11-14H2,1-3H3
InChIKeyHYOCODPYQSKURA-UHFFFAOYSA-N
XLogP3.75
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine 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

N-ethyl-1-[2-(4-methylpiperidin-1-yl)phenyl]propan-1-amine
CID 112677727
1-[1-[2-[1-(ethylamino)propyl]phenyl]piperidin-4-yl]ethanol
CID 106836305
1-[2-(azepan-1-yl)phenyl]-N-ethylpropan-1-amine
CID 112677754
N-[1-[2-(4-ethoxypiperidin-1-yl)phenyl]ethyl]propan-1-amine
CID 61219586
1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]-N-ethylpropan-1-amine
CID 112678203
1-[2-[1-(ethylamino)propyl]phenyl]-1,4-diazepan-5-one
CID 115995191
1-[2-(3-methylpyrrolidin-1-yl)phenyl]-N-propylpropan-1-amine
CID 112677950
1-[2-[4-(2-hydroxyethoxy)piperidin-1-yl]phenyl]propan-1-ol
CID 115996046
1-[2-(azepan-1-yl)phenyl]-N-propylpropan-1-amine
CID 115994785
[1-[2-[1-(methylamino)propyl]phenyl]piperidin-4-yl]methanol
CID 112677818
1-[2-[1-(ethylamino)propyl]phenyl]-N,N,4-trimethylpyrrolidin-3-amine
CID 115995389
1-[2-(2,5-dimethylpiperidin-1-yl)phenyl]-N-ethylpropan-1-amine
CID 115995307

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine?
The IUPAC name of 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine (CID 115994916) is 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine.
What is the SMILES notation for 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine?
The canonical SMILES for 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine is CCNC(CC)c1ccccc1N1CCC(OCC)CC1.
What is the InChIKey of 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine?
The InChIKey is HYOCODPYQSKURA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-17(19-5-2)16-9-7-8-10-18(16)20-13-11-15(12-14-20)21-6-3/h7-10,15,17,19H,4-6,11-14H2,1-3H3.
What are the key properties of 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine?
1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine has a molecular weight of 290.45 g/mol, XLogP of 3.75, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-ethoxypiperidin-1-yl)phenyl]-N-ethylpropan-1-amine is sourced from PubChem (CID 115994916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).