4-chloro-2,3-dihydroquinoline

C9H8ClN — CID 123394411

IUPAC4-chloro-2,3-dihydroquinoline
SMILESClC1=c2ccccc2=NCC1
InChIInChI=1S/C9H8ClN/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4H,5-6H2
InChIKeyOWULFTJHFDIBSS-UHFFFAOYSA-N
MW165.62 g/mol
LogP1.06
Rot. Bonds

About 4-chloro-2,3-dihydroquinoline

4-chloro-2,3-dihydroquinoline (PubChem CID 123394411) has the molecular formula C9H8ClN and a molecular weight of 165.62 g/mol. Its IUPAC name is 4-chloro-2,3-dihydroquinoline.

Molecular Properties

Compound Name4-chloro-2,3-dihydroquinoline
PubChem CID123394411
Molecular FormulaC9H8ClN
Molecular Weight165.62 g/mol
Exact Mass165.03
IUPAC Name4-chloro-2,3-dihydroquinoline
SMILESClC1=c2ccccc2=NCC1
InChIInChI=1S/C9H8ClN/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4H,5-6H2
InChIKeyOWULFTJHFDIBSS-UHFFFAOYSA-N
XLogP1.06
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.62
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-chloro-2,3-dihydroquinoline 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

3h-Quinoline
CID 22027752
4-Methyl-2,3-dihydroquinoline
CID 68274032
7-Fluoro-2,3-dihydroquinoline
CID 151940112
2-Fluoro-2,3-dihydroquinoline
CID 152083894
6-Fluoro-2,6-dihydroquinoline
CID 173531805
7-Chloroquinolin-4-ylzinc iodide, 0.25 M in THF
CID 85735499
4-Chloro-2,3,5,6-tetrahydroquinoline
CID 21082819
2,3-Dihydrobenzo[g]quinoline
CID 21712583
(6Z,10aZ,12Z)-benzo[c][1]benzazocine;hydrochloride
CID 23633136
2,8-Dihydroquinoline
CID 53423727
3(2H)-Quinolinimine
CID 53424822
5-Methyl-2,3-dihydroquinoline
CID 67559344

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2,3-dihydroquinoline?
The IUPAC name of 4-chloro-2,3-dihydroquinoline (CID 123394411) is 4-chloro-2,3-dihydroquinoline.
What is the SMILES notation for 4-chloro-2,3-dihydroquinoline?
The canonical SMILES for 4-chloro-2,3-dihydroquinoline is ClC1=c2ccccc2=NCC1.
What is the InChIKey of 4-chloro-2,3-dihydroquinoline?
The InChIKey is OWULFTJHFDIBSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4H,5-6H2.
What are the key properties of 4-chloro-2,3-dihydroquinoline?
4-chloro-2,3-dihydroquinoline has a molecular weight of 165.62 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2,3-dihydroquinoline is sourced from PubChem (CID 123394411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).