8-(3-chlorophenyl)-6-methylquinoline

C16H12ClN — CID 19381187

IUPAC8-(3-chlorophenyl)-6-methylquinoline
SMILESCc1cc(-c2cccc(Cl)c2)c2ncccc2c1
InChIInChI=1S/C16H12ClN/c1-11-8-13-5-3-7-18-16(13)15(9-11)12-4-2-6-14(17)10-12/h2-10H,1H3
InChIKeyANJPWGFYSPJOLE-UHFFFAOYSA-N
MW253.73 g/mol
LogP4.86
Rot. Bonds1

About 8-(3-chlorophenyl)-6-methylquinoline

8-(3-chlorophenyl)-6-methylquinoline (PubChem CID 19381187) has the molecular formula C16H12ClN and a molecular weight of 253.73 g/mol. Its IUPAC name is 8-(3-chlorophenyl)-6-methylquinoline.

Molecular Properties

Compound Name8-(3-chlorophenyl)-6-methylquinoline
PubChem CID19381187
Molecular FormulaC16H12ClN
Molecular Weight253.73 g/mol
Exact Mass253.07
IUPAC Name8-(3-chlorophenyl)-6-methylquinoline
SMILESCc1cc(-c2cccc(Cl)c2)c2ncccc2c1
InChIInChI=1S/C16H12ClN/c1-11-8-13-5-3-7-18-16(13)15(9-11)12-4-2-6-14(17)10-12/h2-10H,1H3
InChIKeyANJPWGFYSPJOLE-UHFFFAOYSA-N
XLogP4.86
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.73
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-(3-chlorophenyl)-6-methylquinoline?
The IUPAC name of 8-(3-chlorophenyl)-6-methylquinoline (CID 19381187) is 8-(3-chlorophenyl)-6-methylquinoline.
What is the SMILES notation for 8-(3-chlorophenyl)-6-methylquinoline?
The canonical SMILES for 8-(3-chlorophenyl)-6-methylquinoline is Cc1cc(-c2cccc(Cl)c2)c2ncccc2c1.
What is the InChIKey of 8-(3-chlorophenyl)-6-methylquinoline?
The InChIKey is ANJPWGFYSPJOLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClN/c1-11-8-13-5-3-7-18-16(13)15(9-11)12-4-2-6-14(17)10-12/h2-10H,1H3.
What are the key properties of 8-(3-chlorophenyl)-6-methylquinoline?
8-(3-chlorophenyl)-6-methylquinoline has a molecular weight of 253.73 g/mol, XLogP of 4.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-chlorophenyl)-6-methylquinoline is sourced from PubChem (CID 19381187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).