1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine

C17H15ClN2 — CID 82781912

IUPAC1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine
SMILESCC(N)c1ccc(-c2ccc3ncccc3c2)cc1Cl
InChIInChI=1S/C17H15ClN2/c1-11(19)15-6-4-13(10-16(15)18)12-5-7-17-14(9-12)3-2-8-20-17/h2-11H,19H2,1H3
InChIKeyGFTORNFYVQCLKK-UHFFFAOYSA-N
MW282.77 g/mol
LogP4.57
Rot. Bonds2

About 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine

1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine (PubChem CID 82781912) has the molecular formula C17H15ClN2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine.

Molecular Properties

Compound Name1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine
PubChem CID82781912
Molecular FormulaC17H15ClN2
Molecular Weight282.77 g/mol
Exact Mass282.09
IUPAC Name1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine
SMILESCC(N)c1ccc(-c2ccc3ncccc3c2)cc1Cl
InChIInChI=1S/C17H15ClN2/c1-11(19)15-6-4-13(10-16(15)18)12-5-7-17-14(9-12)3-2-8-20-17/h2-11H,19H2,1H3
InChIKeyGFTORNFYVQCLKK-UHFFFAOYSA-N
XLogP4.57
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-chloro-4-quinolin-6-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

3-methyl-1-(4-quinolin-6-ylphenyl)butan-2-amine
CID 82541687
4-(3-quinolin-6-ylphenyl)butan-2-amine
CID 82541692
2-chloro-7-quinolin-6-ylquinoline
CID 176598696
6-(3-quinolin-6-ylbutan-2-yl)quinoline
CID 20658775
6-(3-methylphenyl)quinoline
CID 4185278
6-(6-chloropyridazin-3-yl)quinoline
CID 81221489
(1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 104901602
(2-chloro-4-fluorophenyl)-quinolin-6-ylmethanol
CID 81220584
(3-chloro-4-iodophenyl)-quinolin-6-ylmethanamine
CID 103215982
1-[2-chloro-4-(2,3,4,5,6-pentamethylphenyl)phenyl]ethanamine
CID 82777645
(4-chloro-1-propan-2-ylpyrazol-5-yl)-quinolin-6-ylmethanamine
CID 114651326
2-quinolin-6-ylpropan-1-amine
CID 79002101

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine?
The IUPAC name of 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine (CID 82781912) is 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine.
What is the SMILES notation for 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine?
The canonical SMILES for 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine is CC(N)c1ccc(-c2ccc3ncccc3c2)cc1Cl.
What is the InChIKey of 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine?
The InChIKey is GFTORNFYVQCLKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2/c1-11(19)15-6-4-13(10-16(15)18)12-5-7-17-14(9-12)3-2-8-20-17/h2-11H,19H2,1H3.
What are the key properties of 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine?
1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine has a molecular weight of 282.77 g/mol, XLogP of 4.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4-quinolin-6-ylphenyl)ethanamine is sourced from PubChem (CID 82781912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).