2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine

C16H26N2O — CID 55227894

IUPAC2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine
SMILESCCOCCN(CC)Cc1ccc2c(c1)CCCN2
InChIInChI=1S/C16H26N2O/c1-3-18(10-11-19-4-2)13-14-7-8-16-15(12-14)6-5-9-17-16/h7-8,12,17H,3-6,9-11,13H2,1-2H3
InChIKeyRFQGSYNCHLQHNU-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.90
Rot. Bonds7

About 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine

2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine (PubChem CID 55227894) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine
PubChem CID55227894
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine
SMILESCCOCCN(CC)Cc1ccc2c(c1)CCCN2
InChIInChI=1S/C16H26N2O/c1-3-18(10-11-19-4-2)13-14-7-8-16-15(12-14)6-5-9-17-16/h7-8,12,17H,3-6,9-11,13H2,1-2H3
InChIKeyRFQGSYNCHLQHNU-UHFFFAOYSA-N
XLogP2.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)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

N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-ethylethanamine
CID 22898575
N-(2,3-dihydro-1H-isoindol-5-ylmethyl)-2-ethoxy-N-ethylethanamine
CID 103998308
2-(2,3-dihydro-1H-indol-5-yl)-N,N-diethylethanamine
CID 82255784
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methoxyethyl)-2-methylpropan-1-amine
CID 54985987
N-methyl-2-propan-2-yloxy-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine
CID 81056760
N-propan-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-1-amine
CID 43269701
N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine
CID 43541283
1-cyclobutyl-N-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)methanamine
CID 62861548
3-(diethylamino)-1-(1,2,3,4-tetrahydroquinolin-6-yl)propan-1-one
CID 82050719
N-ethyl-N-propyl-1,2,3,4-tetrahydroquinolin-6-amine
CID 81215271
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-propylcyclopropanamine
CID 43270522
1-(3-chlorophenyl)-N-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)methanamine
CID 61416936

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine?
The IUPAC name of 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine (CID 55227894) is 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine.
What is the SMILES notation for 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine?
The canonical SMILES for 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine is CCOCCN(CC)Cc1ccc2c(c1)CCCN2.
What is the InChIKey of 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine?
The InChIKey is RFQGSYNCHLQHNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-18(10-11-19-4-2)13-14-7-8-16-15(12-14)6-5-9-17-16/h7-8,12,17H,3-6,9-11,13H2,1-2H3.
What are the key properties of 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine?
2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine has a molecular weight of 262.40 g/mol, XLogP of 2.90, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine is sourced from PubChem (CID 55227894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).