About 4-pyrazolidin-4-ylpyrimidine
4-pyrazolidin-4-ylpyrimidine (PubChem CID 71650386) has the molecular formula C7H10N4
and a molecular weight of 150.19 g/mol. Its IUPAC name is 4-pyrazolidin-4-ylpyrimidine.
Molecular Properties
| Compound Name | 4-pyrazolidin-4-ylpyrimidine |
| PubChem CID | 71650386 |
| Molecular Formula | C7H10N4 |
| Molecular Weight | 150.19 g/mol |
| Exact Mass | 150.09 |
| IUPAC Name | 4-pyrazolidin-4-ylpyrimidine |
| SMILES | c1cc(C2CNNC2)ncn1 |
| InChI | InChI=1S/C7H10N4/c1-2-8-5-9-7(1)6-3-10-11-4-6/h1-2,5-6,10-11H,3-4H2 |
| InChIKey | GSUCOUCUYVVXHH-UHFFFAOYSA-N |
| XLogP | -0.33 |
| TPSA | 49.84 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 150.19 |
| LogP ≤ 5 | -0.33 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 4-pyrazolidin-4-ylpyrimidine?
The IUPAC name of 4-pyrazolidin-4-ylpyrimidine (CID 71650386) is 4-pyrazolidin-4-ylpyrimidine.
What is the SMILES notation for 4-pyrazolidin-4-ylpyrimidine?
The canonical SMILES for 4-pyrazolidin-4-ylpyrimidine is c1cc(C2CNNC2)ncn1.
What is the InChIKey of 4-pyrazolidin-4-ylpyrimidine?
The InChIKey is GSUCOUCUYVVXHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4/c1-2-8-5-9-7(1)6-3-10-11-4-6/h1-2,5-6,10-11H,3-4H2.
What are the key properties of 4-pyrazolidin-4-ylpyrimidine?
4-pyrazolidin-4-ylpyrimidine has a molecular weight of 150.19 g/mol, XLogP of -0.33, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrazolidin-4-ylpyrimidine is sourced from PubChem (CID 71650386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).