About N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide
N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide (PubChem CID 119893081) has the molecular formula C10H16N4O
and a molecular weight of 208.26 g/mol. Its IUPAC name is N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide.
Molecular Properties
| Compound Name | N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide |
| PubChem CID | 119893081 |
| Molecular Formula | C10H16N4O |
| Molecular Weight | 208.26 g/mol |
| Exact Mass | 208.13 |
| IUPAC Name | N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide |
| SMILES | CN(C(=O)C1CCCN1)c1cnn(C)c1 |
| InChI | InChI=1S/C10H16N4O/c1-13-7-8(6-12-13)14(2)10(15)9-4-3-5-11-9/h6-7,9,11H,3-5H2,1-2H3 |
| InChIKey | CUIMIXVBSLRHMI-UHFFFAOYSA-N |
| XLogP | 0.13 |
| TPSA | 50.16 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 208.26 |
| LogP ≤ 5 | 0.13 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide (CID 119893081) is N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide is CN(C(=O)C1CCCN1)c1cnn(C)c1.
What is the InChIKey of N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide?
The InChIKey is CUIMIXVBSLRHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-13-7-8(6-12-13)14(2)10(15)9-4-3-5-11-9/h6-7,9,11H,3-5H2,1-2H3.
What are the key properties of N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide?
N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 119893081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).