About 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine
1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine (PubChem CID 79678428) has the molecular formula C9H16N4O
and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine.
Molecular Properties
| Compound Name | 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine |
| PubChem CID | 79678428 |
| Molecular Formula | C9H16N4O |
| Molecular Weight | 196.25 g/mol |
| Exact Mass | 196.13 |
| IUPAC Name | 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine |
| SMILES | Cn1ncc(CN2CCOCC2)c1N |
| InChI | InChI=1S/C9H16N4O/c1-12-9(10)8(6-11-12)7-13-2-4-14-5-3-13/h6H,2-5,7,10H2,1H3 |
| InChIKey | AZWSLVYASYGYDJ-UHFFFAOYSA-N |
| XLogP | -0.17 |
| TPSA | 56.31 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 196.25 |
| LogP ≤ 5 | -0.17 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine?
The IUPAC name of 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine (CID 79678428) is 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine.
What is the SMILES notation for 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine?
The canonical SMILES for 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine is Cn1ncc(CN2CCOCC2)c1N.
What is the InChIKey of 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine?
The InChIKey is AZWSLVYASYGYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-12-9(10)8(6-11-12)7-13-2-4-14-5-3-13/h6H,2-5,7,10H2,1H3.
What are the key properties of 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine?
1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine has a molecular weight of 196.25 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine is sourced from PubChem (CID 79678428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).