2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine

C16H14ClN3 — CID 67511829

IUPAC2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine
SMILESNCCc1cnc2c(Cl)cccc2c1-c1ccccn1
InChIInChI=1S/C16H14ClN3/c17-13-5-3-4-12-15(14-6-1-2-9-19-14)11(7-8-18)10-20-16(12)13/h1-6,9-10H,7-8,18H2
InChIKeyJCWLCEFUDSCYBC-UHFFFAOYSA-N
MW283.76 g/mol
LogP3.45
Rot. Bonds3

About 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine

2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine (PubChem CID 67511829) has the molecular formula C16H14ClN3 and a molecular weight of 283.76 g/mol. Its IUPAC name is 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine.

Molecular Properties

Compound Name2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine
PubChem CID67511829
Molecular FormulaC16H14ClN3
Molecular Weight283.76 g/mol
Exact Mass283.09
IUPAC Name2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine
SMILESNCCc1cnc2c(Cl)cccc2c1-c1ccccn1
InChIInChI=1S/C16H14ClN3/c17-13-5-3-4-12-15(14-6-1-2-9-19-14)11(7-8-18)10-20-16(12)13/h1-6,9-10H,7-8,18H2
InChIKeyJCWLCEFUDSCYBC-UHFFFAOYSA-N
XLogP3.45
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-pyridin-2-ylphenyl)ethanamine
CID 22356817
4-amino-6-[2-(8-chloro-6-fluoro-4-pyridin-2-ylquinolin-3-yl)ethylamino]pyrimidine-5-carbonitrile
CID 67512024
2-(8-fluoro-2-pyridin-2-ylquinolin-3-yl)ethanamine
CID 130408040
azane;2-(2-chlorophenyl)ethanamine
CID 70087147
1-(8-chloro-6-fluoro-4-pyridin-2-ylquinolin-3-yl)ethanamine
CID 67512321
2-(4-bromo-8-chloroquinolin-3-yl)ethyl formate
CID 174583198
2-(3-chloro-2-iodophenyl)pyridine
CID 11290028
2-(8-chloro-4-methylquinolin-2-yl)ethanamine
CID 82575547
2-(2-pyridin-2-yl-1H-indol-3-yl)ethanamine
CID 2771640
2-(3-pyridin-2-ylphenyl)ethanamine
CID 39226476
2-(2,4,6-trichlorophenyl)pyridine
CID 71658630
8-chloro-3-ethyl-2-pyridin-2-ylquinoline
CID 70898648

Frequently Asked Questions

What is the IUPAC name of 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine?
The IUPAC name of 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine (CID 67511829) is 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine.
What is the SMILES notation for 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine?
The canonical SMILES for 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine is NCCc1cnc2c(Cl)cccc2c1-c1ccccn1.
What is the InChIKey of 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine?
The InChIKey is JCWLCEFUDSCYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3/c17-13-5-3-4-12-15(14-6-1-2-9-19-14)11(7-8-18)10-20-16(12)13/h1-6,9-10H,7-8,18H2.
What are the key properties of 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine?
2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine has a molecular weight of 283.76 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-chloro-4-pyridin-2-ylquinolin-3-yl)ethanamine is sourced from PubChem (CID 67511829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).