N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine

C17H19FN2 — CID 81215536

IUPACN-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine
SMILESCCN(c1ccccc1F)c1cccc2c1NCCC2
InChIInChI=1S/C17H19FN2/c1-2-20(15-10-4-3-9-14(15)18)16-11-5-7-13-8-6-12-19-17(13)16/h3-5,7,9-11,19H,2,6,8,12H2,1H3
InChIKeyYXCCIOGYLSADMX-UHFFFAOYSA-N
MW270.35 g/mol
LogP4.34
Rot. Bonds3

About N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine

N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine (PubChem CID 81215536) has the molecular formula C17H19FN2 and a molecular weight of 270.35 g/mol. Its IUPAC name is N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine
PubChem CID81215536
Molecular FormulaC17H19FN2
Molecular Weight270.35 g/mol
Exact Mass270.15
IUPAC NameN-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine
SMILESCCN(c1ccccc1F)c1cccc2c1NCCC2
InChIInChI=1S/C17H19FN2/c1-2-20(15-10-4-3-9-14(15)18)16-11-5-7-13-8-6-12-19-17(13)16/h3-5,7,9-11,19H,2,6,8,12H2,1H3
InChIKeyYXCCIOGYLSADMX-UHFFFAOYSA-N
XLogP4.34
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine?
The IUPAC name of N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine (CID 81215536) is N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine.
What is the SMILES notation for N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine?
The canonical SMILES for N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine is CCN(c1ccccc1F)c1cccc2c1NCCC2.
What is the InChIKey of N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine?
The InChIKey is YXCCIOGYLSADMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2/c1-2-20(15-10-4-3-9-14(15)18)16-11-5-7-13-8-6-12-19-17(13)16/h3-5,7,9-11,19H,2,6,8,12H2,1H3.
What are the key properties of N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine?
N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine has a molecular weight of 270.35 g/mol, XLogP of 4.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinolin-8-amine is sourced from PubChem (CID 81215536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).