9-chloro-[1,3]dioxolo[4,5-g]quinoline

C10H6ClNO2 — CID 156692579

IUPAC9-chloro-[1,3]dioxolo[4,5-g]quinoline
SMILESClc1c2c(cc3ncccc13)OCO2
InChIInChI=1S/C10H6ClNO2/c11-9-6-2-1-3-12-7(6)4-8-10(9)14-5-13-8/h1-4H,5H2
InChIKeyLNCVXKXFGGWLJD-UHFFFAOYSA-N
MW207.62 g/mol
LogP2.62
Rot. Bonds

About 9-chloro-[1,3]dioxolo[4,5-g]quinoline

9-chloro-[1,3]dioxolo[4,5-g]quinoline (PubChem CID 156692579) has the molecular formula C10H6ClNO2 and a molecular weight of 207.62 g/mol. Its IUPAC name is 9-chloro-[1,3]dioxolo[4,5-g]quinoline.

Molecular Properties

Compound Name9-chloro-[1,3]dioxolo[4,5-g]quinoline
PubChem CID156692579
Molecular FormulaC10H6ClNO2
Molecular Weight207.62 g/mol
Exact Mass207.01
IUPAC Name9-chloro-[1,3]dioxolo[4,5-g]quinoline
SMILESClc1c2c(cc3ncccc13)OCO2
InChIInChI=1S/C10H6ClNO2/c11-9-6-2-1-3-12-7(6)4-8-10(9)14-5-13-8/h1-4H,5H2
InChIKeyLNCVXKXFGGWLJD-UHFFFAOYSA-N
XLogP2.62
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.62
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9-chloro-[1,3]dioxolo[4,5-g]quinoline 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 9-chloro-[1,3]dioxolo[4,5-g]quinoline?
The IUPAC name of 9-chloro-[1,3]dioxolo[4,5-g]quinoline (CID 156692579) is 9-chloro-[1,3]dioxolo[4,5-g]quinoline.
What is the SMILES notation for 9-chloro-[1,3]dioxolo[4,5-g]quinoline?
The canonical SMILES for 9-chloro-[1,3]dioxolo[4,5-g]quinoline is Clc1c2c(cc3ncccc13)OCO2.
What is the InChIKey of 9-chloro-[1,3]dioxolo[4,5-g]quinoline?
The InChIKey is LNCVXKXFGGWLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClNO2/c11-9-6-2-1-3-12-7(6)4-8-10(9)14-5-13-8/h1-4H,5H2.
What are the key properties of 9-chloro-[1,3]dioxolo[4,5-g]quinoline?
9-chloro-[1,3]dioxolo[4,5-g]quinoline has a molecular weight of 207.62 g/mol, XLogP of 2.62, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-chloro-[1,3]dioxolo[4,5-g]quinoline is sourced from PubChem (CID 156692579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).