8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline

C17H12ClN3 — CID 175243886

IUPAC8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline
SMILESCc1cccc(-n2cnc3cnc4ccc(Cl)cc4c32)c1
InChIInChI=1S/C17H12ClN3/c1-11-3-2-4-13(7-11)21-10-20-16-9-19-15-6-5-12(18)8-14(15)17(16)21/h2-10H,1H3
InChIKeyVURZCYRAGUGXCU-UHFFFAOYSA-N
MW293.76 g/mol
LogP4.54
Rot. Bonds1

About 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline

8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline (PubChem CID 175243886) has the molecular formula C17H12ClN3 and a molecular weight of 293.76 g/mol. Its IUPAC name is 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline
PubChem CID175243886
Molecular FormulaC17H12ClN3
Molecular Weight293.76 g/mol
Exact Mass293.07
IUPAC Name8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline
SMILESCc1cccc(-n2cnc3cnc4ccc(Cl)cc4c32)c1
InChIInChI=1S/C17H12ClN3/c1-11-3-2-4-13(7-11)21-10-20-16-9-19-15-6-5-12(18)8-14(15)17(16)21/h2-10H,1H3
InChIKeyVURZCYRAGUGXCU-UHFFFAOYSA-N
XLogP4.54
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.76
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline?
The IUPAC name of 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline (CID 175243886) is 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline.
What is the SMILES notation for 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline?
The canonical SMILES for 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline is Cc1cccc(-n2cnc3cnc4ccc(Cl)cc4c32)c1.
What is the InChIKey of 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline?
The InChIKey is VURZCYRAGUGXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClN3/c1-11-3-2-4-13(7-11)21-10-20-16-9-19-15-6-5-12(18)8-14(15)17(16)21/h2-10H,1H3.
What are the key properties of 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline?
8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline has a molecular weight of 293.76 g/mol, XLogP of 4.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-1-(3-methylphenyl)imidazo[4,5-c]quinoline is sourced from PubChem (CID 175243886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).