About (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine
(4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine (PubChem CID 8892568) has the molecular formula C19H20N4O
and a molecular weight of 320.40 g/mol. Its IUPAC name is (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine.
Molecular Properties
| Compound Name | (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine |
| PubChem CID | 8892568 |
| Molecular Formula | C19H20N4O |
| Molecular Weight | 320.40 g/mol |
| Exact Mass | 320.16 |
| IUPAC Name | (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine |
| SMILES | CC(C)n1ncc2c1N=C(c1ccco1)N(C)[C@@H]2c1ccccc1 |
| InChI | InChI=1S/C19H20N4O/c1-13(2)23-18-15(12-20-23)17(14-8-5-4-6-9-14)22(3)19(21-18)16-10-7-11-24-16/h4-13,17H,1-3H3/t17-/m1/s1 |
| InChIKey | CSMCQAOJDCFAPC-QGZVFWFLSA-N |
| XLogP | 4.17 |
| TPSA | 46.56 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 320.40 |
| LogP ≤ 5 | 4.17 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine?
The IUPAC name of (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine (CID 8892568) is (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine.
What is the SMILES notation for (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine?
The canonical SMILES for (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine is CC(C)n1ncc2c1N=C(c1ccco1)N(C)[C@@H]2c1ccccc1.
What is the InChIKey of (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine?
The InChIKey is CSMCQAOJDCFAPC-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13(2)23-18-15(12-20-23)17(14-8-5-4-6-9-14)22(3)19(21-18)16-10-7-11-24-16/h4-13,17H,1-3H3/t17-/m1/s1.
What are the key properties of (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine?
(4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine has a molecular weight of 320.40 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine is sourced from PubChem (CID 8892568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).