9-chloro-6H-imidazo[4,5-f]quinoline

C10H6ClN3 — CID 135712933

IUPAC9-chloro-6H-imidazo[4,5-f]quinoline
SMILESClc1cc[nH]c2ccc3ncnc3c12
InChIInChI=1S/C10H6ClN3/c11-6-3-4-12-7-1-2-8-10(9(6)7)14-5-13-8/h1-5,12H
InChIKeyPNDDUMGAHWSSQY-UHFFFAOYSA-N
MW203.63 g/mol
LogP2.76
Rot. Bonds

About 9-chloro-6H-imidazo[4,5-f]quinoline

9-chloro-6H-imidazo[4,5-f]quinoline (PubChem CID 135712933) has the molecular formula C10H6ClN3 and a molecular weight of 203.63 g/mol. Its IUPAC name is 9-chloro-6H-imidazo[4,5-f]quinoline.

Molecular Properties

Compound Name9-chloro-6H-imidazo[4,5-f]quinoline
PubChem CID135712933
Molecular FormulaC10H6ClN3
Molecular Weight203.63 g/mol
Exact Mass203.03
IUPAC Name9-chloro-6H-imidazo[4,5-f]quinoline
SMILESClc1cc[nH]c2ccc3ncnc3c12
InChIInChI=1S/C10H6ClN3/c11-6-3-4-12-7-1-2-8-10(9(6)7)14-5-13-8/h1-5,12H
InChIKeyPNDDUMGAHWSSQY-UHFFFAOYSA-N
XLogP2.76
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.63
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-chloro-6H-imidazo[4,5-f]quinoline?
The IUPAC name of 9-chloro-6H-imidazo[4,5-f]quinoline (CID 135712933) is 9-chloro-6H-imidazo[4,5-f]quinoline.
What is the SMILES notation for 9-chloro-6H-imidazo[4,5-f]quinoline?
The canonical SMILES for 9-chloro-6H-imidazo[4,5-f]quinoline is Clc1cc[nH]c2ccc3ncnc3c12.
What is the InChIKey of 9-chloro-6H-imidazo[4,5-f]quinoline?
The InChIKey is PNDDUMGAHWSSQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClN3/c11-6-3-4-12-7-1-2-8-10(9(6)7)14-5-13-8/h1-5,12H.
What are the key properties of 9-chloro-6H-imidazo[4,5-f]quinoline?
9-chloro-6H-imidazo[4,5-f]quinoline has a molecular weight of 203.63 g/mol, XLogP of 2.76, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-chloro-6H-imidazo[4,5-f]quinoline is sourced from PubChem (CID 135712933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).