2,4-dimethylbenzo[h]quinoline

C15H13N — CID 610182

IUPAC2,4-dimethylbenzo[h]quinoline
SMILESCc1cc(C)c2ccc3ccccc3c2n1
InChIInChI=1S/C15H13N/c1-10-9-11(2)16-15-13(10)8-7-12-5-3-4-6-14(12)15/h3-9H,1-2H3
InChIKeyVPSXZUORXQYBAT-UHFFFAOYSA-N
MW207.28 g/mol
LogP4.00
Rot. Bonds

About 2,4-dimethylbenzo[h]quinoline

2,4-dimethylbenzo[h]quinoline (PubChem CID 610182) has the molecular formula C15H13N and a molecular weight of 207.28 g/mol. Its IUPAC name is 2,4-dimethylbenzo[h]quinoline.

Molecular Properties

Compound Name2,4-dimethylbenzo[h]quinoline
PubChem CID610182
Molecular FormulaC15H13N
Molecular Weight207.28 g/mol
Exact Mass207.10
IUPAC Name2,4-dimethylbenzo[h]quinoline
SMILESCc1cc(C)c2ccc3ccccc3c2n1
InChIInChI=1S/C15H13N/c1-10-9-11(2)16-15-13(10)8-7-12-5-3-4-6-14(12)15/h3-9H,1-2H3
InChIKeyVPSXZUORXQYBAT-UHFFFAOYSA-N
XLogP4.00
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 2,4-dimethylbenzo[h]quinoline?
The IUPAC name of 2,4-dimethylbenzo[h]quinoline (CID 610182) is 2,4-dimethylbenzo[h]quinoline.
What is the SMILES notation for 2,4-dimethylbenzo[h]quinoline?
The canonical SMILES for 2,4-dimethylbenzo[h]quinoline is Cc1cc(C)c2ccc3ccccc3c2n1.
What is the InChIKey of 2,4-dimethylbenzo[h]quinoline?
The InChIKey is VPSXZUORXQYBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N/c1-10-9-11(2)16-15-13(10)8-7-12-5-3-4-6-14(12)15/h3-9H,1-2H3.
What are the key properties of 2,4-dimethylbenzo[h]quinoline?
2,4-dimethylbenzo[h]quinoline has a molecular weight of 207.28 g/mol, XLogP of 4.00, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylbenzo[h]quinoline is sourced from PubChem (CID 610182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).