3-(2,6-dichloro-4-pyridinyl)quinoline

C14H8Cl2N2 — CID 86078303

IUPAC3-(2,6-dichloro-4-pyridinyl)quinoline
SMILESClc1cc(-c2cnc3ccccc3c2)cc(Cl)n1
InChIInChI=1S/C14H8Cl2N2/c15-13-6-10(7-14(16)18-13)11-5-9-3-1-2-4-12(9)17-8-11/h1-8H
InChIKeyOSGSVGALUWALKP-UHFFFAOYSA-N
MW275.14 g/mol
LogP4.60
Rot. Bonds1

About 3-(2,6-dichloro-4-pyridinyl)quinoline

3-(2,6-dichloro-4-pyridinyl)quinoline (PubChem CID 86078303) has the molecular formula C14H8Cl2N2 and a molecular weight of 275.14 g/mol. Its IUPAC name is 3-(2,6-dichloro-4-pyridinyl)quinoline.

Molecular Properties

Compound Name3-(2,6-dichloro-4-pyridinyl)quinoline
PubChem CID86078303
Molecular FormulaC14H8Cl2N2
Molecular Weight275.14 g/mol
Exact Mass274.01
IUPAC Name3-(2,6-dichloro-4-pyridinyl)quinoline
SMILESClc1cc(-c2cnc3ccccc3c2)cc(Cl)n1
InChIInChI=1S/C14H8Cl2N2/c15-13-6-10(7-14(16)18-13)11-5-9-3-1-2-4-12(9)17-8-11/h1-8H
InChIKeyOSGSVGALUWALKP-UHFFFAOYSA-N
XLogP4.60
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.14
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 3-(2,6-dichloro-4-pyridinyl)quinoline 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-pyridin-4-ylquinoline
CID 10081720
3-[4-(4-fluorophenyl)phenyl]quinoline
CID 171056588
3-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
CID 58322543
3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinoline
CID 58322553
3-(2,3-dichlorophenyl)quinoline
CID 175328556
3-(1H-pyrazol-4-yl)quinoline
CID 90943604
3-(2-methoxypyrimidin-5-yl)quinoline
CID 101347673
3-(4-heptacyclo[12.10.2.26,9.02,7.08,13.018,26.021,25]octacosa-1(24),2(7),3,5,8,10,12,14,16,18(26),19,21(25),22,27-tetradecaenyl)quinoline
CID 167411808
2-(3-benzo[g]quinolin-2-yl-5-quinolin-3-ylphenyl)benzo[g]quinoline
CID 139364036
3-[4-[4-[3,5-bis(trifluoromethyl)phenyl]phenyl]phenyl]quinoline
CID 171056228
3-[4-(4-phenylphenyl)-6-quinolin-3-yl-1,3,5-triazin-2-yl]quinoline
CID 122426515
3-anthracen-9-ylquinoline
CID 170654314

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dichloro-4-pyridinyl)quinoline?
The IUPAC name of 3-(2,6-dichloro-4-pyridinyl)quinoline (CID 86078303) is 3-(2,6-dichloro-4-pyridinyl)quinoline.
What is the SMILES notation for 3-(2,6-dichloro-4-pyridinyl)quinoline?
The canonical SMILES for 3-(2,6-dichloro-4-pyridinyl)quinoline is Clc1cc(-c2cnc3ccccc3c2)cc(Cl)n1.
What is the InChIKey of 3-(2,6-dichloro-4-pyridinyl)quinoline?
The InChIKey is OSGSVGALUWALKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2N2/c15-13-6-10(7-14(16)18-13)11-5-9-3-1-2-4-12(9)17-8-11/h1-8H.
What are the key properties of 3-(2,6-dichloro-4-pyridinyl)quinoline?
3-(2,6-dichloro-4-pyridinyl)quinoline has a molecular weight of 275.14 g/mol, XLogP of 4.60, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dichloro-4-pyridinyl)quinoline is sourced from PubChem (CID 86078303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).