About 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide
4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide (PubChem CID 175816517) has the molecular formula C19H21N5O3
and a molecular weight of 367.41 g/mol. Its IUPAC name is 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide.
Molecular Properties
| Compound Name | 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide |
| PubChem CID | 175816517 |
| Molecular Formula | C19H21N5O3 |
| Molecular Weight | 367.41 g/mol |
| Exact Mass | 367.16 |
| IUPAC Name | 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide |
| SMILES | COc1ccc(Cn2cc3c(N4CCC(O)C4)ncc(C(N)=O)c3n2)cc1 |
| InChI | InChI=1S/C19H21N5O3/c1-27-14-4-2-12(3-5-14)9-24-11-16-17(22-24)15(18(20)26)8-21-19(16)23-7-6-13(25)10-23/h2-5,8,11,13,25H,6-7,9-10H2,1H3,(H2,20,26) |
| InChIKey | ZSEWFZRUAHGBCH-UHFFFAOYSA-N |
| XLogP | 1.16 |
| TPSA | 106.50 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 367.41 |
| LogP ≤ 5 | 1.16 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 7 |
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Frequently Asked Questions
What is the IUPAC name of 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide?
The IUPAC name of 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide (CID 175816517) is 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide.
What is the SMILES notation for 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide?
The canonical SMILES for 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide is COc1ccc(Cn2cc3c(N4CCC(O)C4)ncc(C(N)=O)c3n2)cc1.
What is the InChIKey of 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide?
The InChIKey is ZSEWFZRUAHGBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-27-14-4-2-12(3-5-14)9-24-11-16-17(22-24)15(18(20)26)8-21-19(16)23-7-6-13(25)10-23/h2-5,8,11,13,25H,6-7,9-10H2,1H3,(H2,20,26).
What are the key properties of 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide?
4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-hydroxypyrrolidin-1-yl)-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 175816517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).