About N-ethyl-1-pyrazol-1-ylpropan-2-amine
N-ethyl-1-pyrazol-1-ylpropan-2-amine (PubChem CID 43435880) has the molecular formula C8H15N3
and a molecular weight of 153.23 g/mol. Its IUPAC name is N-ethyl-1-pyrazol-1-ylpropan-2-amine.
Molecular Properties
| Compound Name | N-ethyl-1-pyrazol-1-ylpropan-2-amine |
| PubChem CID | 43435880 |
| Molecular Formula | C8H15N3 |
| Molecular Weight | 153.23 g/mol |
| Exact Mass | 153.13 |
| IUPAC Name | N-ethyl-1-pyrazol-1-ylpropan-2-amine |
| SMILES | CCNC(C)Cn1cccn1 |
| InChI | InChI=1S/C8H15N3/c1-3-9-8(2)7-11-6-4-5-10-11/h4-6,8-9H,3,7H2,1-2H3 |
| InChIKey | IHFGHUTTWWLZLS-UHFFFAOYSA-N |
| XLogP | 0.88 |
| TPSA | 29.85 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 153.23 |
| LogP ≤ 5 | 0.88 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-ethyl-1-pyrazol-1-ylpropan-2-amine?
The IUPAC name of N-ethyl-1-pyrazol-1-ylpropan-2-amine (CID 43435880) is N-ethyl-1-pyrazol-1-ylpropan-2-amine.
What is the SMILES notation for N-ethyl-1-pyrazol-1-ylpropan-2-amine?
The canonical SMILES for N-ethyl-1-pyrazol-1-ylpropan-2-amine is CCNC(C)Cn1cccn1.
What is the InChIKey of N-ethyl-1-pyrazol-1-ylpropan-2-amine?
The InChIKey is IHFGHUTTWWLZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-3-9-8(2)7-11-6-4-5-10-11/h4-6,8-9H,3,7H2,1-2H3.
What are the key properties of N-ethyl-1-pyrazol-1-ylpropan-2-amine?
N-ethyl-1-pyrazol-1-ylpropan-2-amine has a molecular weight of 153.23 g/mol, XLogP of 0.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-pyrazol-1-ylpropan-2-amine is sourced from PubChem (CID 43435880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).