6-chloro-2-(1H-indol-5-yl)quinoline

C17H11ClN2 — CID 67344104

IUPAC6-chloro-2-(1H-indol-5-yl)quinoline
SMILESClc1ccc2nc(-c3ccc4[nH]ccc4c3)ccc2c1
InChIInChI=1S/C17H11ClN2/c18-14-3-6-17-12(10-14)2-5-16(20-17)11-1-4-15-13(9-11)7-8-19-15/h1-10,19H
InChIKeyPGMDIMNLKQBCKD-UHFFFAOYSA-N
MW278.74 g/mol
LogP5.04
Rot. Bonds1

About 6-chloro-2-(1H-indol-5-yl)quinoline

6-chloro-2-(1H-indol-5-yl)quinoline (PubChem CID 67344104) has the molecular formula C17H11ClN2 and a molecular weight of 278.74 g/mol. Its IUPAC name is 6-chloro-2-(1H-indol-5-yl)quinoline.

Molecular Properties

Compound Name6-chloro-2-(1H-indol-5-yl)quinoline
PubChem CID67344104
Molecular FormulaC17H11ClN2
Molecular Weight278.74 g/mol
Exact Mass278.06
IUPAC Name6-chloro-2-(1H-indol-5-yl)quinoline
SMILESClc1ccc2nc(-c3ccc4[nH]ccc4c3)ccc2c1
InChIInChI=1S/C17H11ClN2/c18-14-3-6-17-12(10-14)2-5-16(20-17)11-1-4-15-13(9-11)7-8-19-15/h1-10,19H
InChIKeyPGMDIMNLKQBCKD-UHFFFAOYSA-N
XLogP5.04
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.74
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(1H-indol-5-yl)quinoline?
The IUPAC name of 6-chloro-2-(1H-indol-5-yl)quinoline (CID 67344104) is 6-chloro-2-(1H-indol-5-yl)quinoline.
What is the SMILES notation for 6-chloro-2-(1H-indol-5-yl)quinoline?
The canonical SMILES for 6-chloro-2-(1H-indol-5-yl)quinoline is Clc1ccc2nc(-c3ccc4[nH]ccc4c3)ccc2c1.
What is the InChIKey of 6-chloro-2-(1H-indol-5-yl)quinoline?
The InChIKey is PGMDIMNLKQBCKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN2/c18-14-3-6-17-12(10-14)2-5-16(20-17)11-1-4-15-13(9-11)7-8-19-15/h1-10,19H.
What are the key properties of 6-chloro-2-(1H-indol-5-yl)quinoline?
6-chloro-2-(1H-indol-5-yl)quinoline has a molecular weight of 278.74 g/mol, XLogP of 5.04, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(1H-indol-5-yl)quinoline is sourced from PubChem (CID 67344104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).