About N,4-dimethylbenzo[h]quinolin-6-amine
N,4-dimethylbenzo[h]quinolin-6-amine (PubChem CID 177168582) has the molecular formula C15H14N2
and a molecular weight of 222.29 g/mol. Its IUPAC name is N,4-dimethylbenzo[h]quinolin-6-amine.
Molecular Properties
| Compound Name | N,4-dimethylbenzo[h]quinolin-6-amine |
| PubChem CID | 177168582 |
| Molecular Formula | C15H14N2 |
| Molecular Weight | 222.29 g/mol |
| Exact Mass | 222.12 |
| IUPAC Name | N,4-dimethylbenzo[h]quinolin-6-amine |
| SMILES | CNc1cc2c(C)ccnc2c2ccccc12 |
| InChI | InChI=1S/C15H14N2/c1-10-7-8-17-15-12-6-4-3-5-11(12)14(16-2)9-13(10)15/h3-9,16H,1-2H3 |
| InChIKey | WLNGVQSUQSGNHP-UHFFFAOYSA-N |
| XLogP | 3.74 |
| TPSA | 24.92 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 222.29 |
| LogP ≤ 5 | 3.74 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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 N,4-dimethylbenzo[h]quinolin-6-amine?
The IUPAC name of N,4-dimethylbenzo[h]quinolin-6-amine (CID 177168582) is N,4-dimethylbenzo[h]quinolin-6-amine.
What is the SMILES notation for N,4-dimethylbenzo[h]quinolin-6-amine?
The canonical SMILES for N,4-dimethylbenzo[h]quinolin-6-amine is CNc1cc2c(C)ccnc2c2ccccc12.
What is the InChIKey of N,4-dimethylbenzo[h]quinolin-6-amine?
The InChIKey is WLNGVQSUQSGNHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-10-7-8-17-15-12-6-4-3-5-11(12)14(16-2)9-13(10)15/h3-9,16H,1-2H3.
What are the key properties of N,4-dimethylbenzo[h]quinolin-6-amine?
N,4-dimethylbenzo[h]quinolin-6-amine has a molecular weight of 222.29 g/mol, XLogP of 3.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethylbenzo[h]quinolin-6-amine is sourced from PubChem (CID 177168582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).