About 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one
7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one (PubChem CID 10037253) has the molecular formula C14H13N3O
and a molecular weight of 239.28 g/mol. Its IUPAC name is 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one.
Molecular Properties
| Compound Name | 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one |
| PubChem CID | 10037253 |
| Molecular Formula | C14H13N3O |
| Molecular Weight | 239.28 g/mol |
| Exact Mass | 239.11 |
| IUPAC Name | 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one |
| SMILES | Cc1nc2c(cc1-c1ccncc1)CCC(=O)N2 |
| InChI | InChI=1S/C14H13N3O/c1-9-12(10-4-6-15-7-5-10)8-11-2-3-13(18)17-14(11)16-9/h4-8H,2-3H2,1H3,(H,16,17,18) |
| InChIKey | BEAOZZCRGBRVNO-UHFFFAOYSA-N |
| XLogP | 2.34 |
| TPSA | 54.88 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 239.28 |
| LogP ≤ 5 | 2.34 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The IUPAC name of 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one (CID 10037253) is 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one is Cc1nc2c(cc1-c1ccncc1)CCC(=O)N2.
What is the InChIKey of 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The InChIKey is BEAOZZCRGBRVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-9-12(10-4-6-15-7-5-10)8-11-2-3-13(18)17-14(11)16-9/h4-8H,2-3H2,1H3,(H,16,17,18).
What are the key properties of 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one?
7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one has a molecular weight of 239.28 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-6-pyridin-4-yl-3,4-dihydro-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 10037253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).