About 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 86923136) has the molecular formula C10H9N3O2
and a molecular weight of 203.20 g/mol. Its IUPAC name is 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
Molecular Properties
| Compound Name | 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide |
| PubChem CID | 86923136 |
| Molecular Formula | C10H9N3O2 |
| Molecular Weight | 203.20 g/mol |
| Exact Mass | 203.07 |
| IUPAC Name | 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide |
| SMILES | Cc1ccc2ncc(C(N)=O)c(=O)n2c1 |
| InChI | InChI=1S/C10H9N3O2/c1-6-2-3-8-12-4-7(9(11)14)10(15)13(8)5-6/h2-5H,1H3,(H2,11,14) |
| InChIKey | GOQGHDRCPGPRMZ-UHFFFAOYSA-N |
| XLogP | 0.10 |
| TPSA | 77.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 203.20 |
| LogP ≤ 5 | 0.10 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (CID 86923136) is 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is Cc1ccc2ncc(C(N)=O)c(=O)n2c1.
What is the InChIKey of 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is GOQGHDRCPGPRMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c1-6-2-3-8-12-4-7(9(11)14)10(15)13(8)5-6/h2-5H,1H3,(H2,11,14).
What are the key properties of 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 203.20 g/mol, XLogP of 0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 86923136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).