6,8-dimethoxy-4-methylbenzo[h]quinoline

C16H15NO2 — CID 11807182

IUPAC6,8-dimethoxy-4-methylbenzo[h]quinoline
SMILESCOc1ccc2c(c1)c(OC)cc1c(C)ccnc12
InChIInChI=1S/C16H15NO2/c1-10-6-7-17-16-12-5-4-11(18-2)8-14(12)15(19-3)9-13(10)16/h4-9H,1-3H3
InChIKeyDYNQYILXQMGRPX-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.71
Rot. Bonds2

About 6,8-dimethoxy-4-methylbenzo[h]quinoline

6,8-dimethoxy-4-methylbenzo[h]quinoline (PubChem CID 11807182) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 6,8-dimethoxy-4-methylbenzo[h]quinoline.

Molecular Properties

Compound Name6,8-dimethoxy-4-methylbenzo[h]quinoline
PubChem CID11807182
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name6,8-dimethoxy-4-methylbenzo[h]quinoline
SMILESCOc1ccc2c(c1)c(OC)cc1c(C)ccnc12
InChIInChI=1S/C16H15NO2/c1-10-6-7-17-16-12-5-4-11(18-2)8-14(12)15(19-3)9-13(10)16/h4-9H,1-3H3
InChIKeyDYNQYILXQMGRPX-UHFFFAOYSA-N
XLogP3.71
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6,8-dimethoxy-4-methylbenzo[h]quinoline?
The IUPAC name of 6,8-dimethoxy-4-methylbenzo[h]quinoline (CID 11807182) is 6,8-dimethoxy-4-methylbenzo[h]quinoline.
What is the SMILES notation for 6,8-dimethoxy-4-methylbenzo[h]quinoline?
The canonical SMILES for 6,8-dimethoxy-4-methylbenzo[h]quinoline is COc1ccc2c(c1)c(OC)cc1c(C)ccnc12.
What is the InChIKey of 6,8-dimethoxy-4-methylbenzo[h]quinoline?
The InChIKey is DYNQYILXQMGRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-10-6-7-17-16-12-5-4-11(18-2)8-14(12)15(19-3)9-13(10)16/h4-9H,1-3H3.
What are the key properties of 6,8-dimethoxy-4-methylbenzo[h]quinoline?
6,8-dimethoxy-4-methylbenzo[h]quinoline has a molecular weight of 253.30 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethoxy-4-methylbenzo[h]quinoline is sourced from PubChem (CID 11807182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).