6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline

C18H12ClFN2 — CID 18729693

IUPAC6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline
SMILESCn1cc(-c2ccc3cc(Cl)ccc3n2)c2c(F)cccc21
InChIInChI=1S/C18H12ClFN2/c1-22-10-13(18-14(20)3-2-4-17(18)22)16-7-5-11-9-12(19)6-8-15(11)21-16/h2-10H,1H3
InChIKeyYAWPJUGKBJVJEA-UHFFFAOYSA-N
MW310.76 g/mol
LogP5.19
Rot. Bonds1

About 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline

6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline (PubChem CID 18729693) has the molecular formula C18H12ClFN2 and a molecular weight of 310.76 g/mol. Its IUPAC name is 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline.

Molecular Properties

Compound Name6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline
PubChem CID18729693
Molecular FormulaC18H12ClFN2
Molecular Weight310.76 g/mol
Exact Mass310.07
IUPAC Name6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline
SMILESCn1cc(-c2ccc3cc(Cl)ccc3n2)c2c(F)cccc21
InChIInChI=1S/C18H12ClFN2/c1-22-10-13(18-14(20)3-2-4-17(18)22)16-7-5-11-9-12(19)6-8-15(11)21-16/h2-10H,1H3
InChIKeyYAWPJUGKBJVJEA-UHFFFAOYSA-N
XLogP5.19
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.76
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-chloro-2-(4-fluoro-1-methylindol-3-yl)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

[2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine
CID 115114192
6-chloro-2-(2-methoxyphenyl)quinoline
CID 39818676
2-(2-fluorophenyl)-6-methylquinoline
CID 58774468
2-[4-[3-(6-chloroquinolin-2-yl)-6-fluoroindol-1-yl]butyl]isoindole-1,3-dione
CID 18729481
5-(4-fluoro-1-methylindol-3-yl)-1-methylpyrazole-3-carboxylic acid
CID 115108326
3-(6-chloroquinolin-2-yl)aniline
CID 44569223
CID 164677477
CID 164677477
1-(4-fluoro-1-methylindol-3-yl)ethanol
CID 117119627
6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine
CID 115110648
6-chloro-2-(1-chloroethyl)-1-(2,3-difluorophenyl)benzimidazole
CID 115471164
6-chloro-2-(1H-pyrazol-4-yl)quinoline
CID 164550174
6-chloro-2-(1-chloroethyl)-1-(2,6-difluorophenyl)benzimidazole
CID 115470912

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline?
The IUPAC name of 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline (CID 18729693) is 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline.
What is the SMILES notation for 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline?
The canonical SMILES for 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline is Cn1cc(-c2ccc3cc(Cl)ccc3n2)c2c(F)cccc21.
What is the InChIKey of 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline?
The InChIKey is YAWPJUGKBJVJEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClFN2/c1-22-10-13(18-14(20)3-2-4-17(18)22)16-7-5-11-9-12(19)6-8-15(11)21-16/h2-10H,1H3.
What are the key properties of 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline?
6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline has a molecular weight of 310.76 g/mol, XLogP of 5.19, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline is sourced from PubChem (CID 18729693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).