About [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine
[1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine (PubChem CID 105315159) has the molecular formula C11H16ClN3
and a molecular weight of 225.72 g/mol. Its IUPAC name is [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine.
Molecular Properties
| Compound Name | [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine |
| PubChem CID | 105315159 |
| Molecular Formula | C11H16ClN3 |
| Molecular Weight | 225.72 g/mol |
| Exact Mass | 225.10 |
| IUPAC Name | [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine |
| SMILES | NNC(CCC1CC1)c1ccncc1Cl |
| InChI | InChI=1S/C11H16ClN3/c12-10-7-14-6-5-9(10)11(15-13)4-3-8-1-2-8/h5-8,11,15H,1-4,13H2 |
| InChIKey | MSCZAVVOBSZGMG-UHFFFAOYSA-N |
| XLogP | 2.43 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 225.72 |
| LogP ≤ 5 | 2.43 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine?
The IUPAC name of [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine (CID 105315159) is [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine?
The canonical SMILES for [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine is NNC(CCC1CC1)c1ccncc1Cl.
What is the InChIKey of [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine?
The InChIKey is MSCZAVVOBSZGMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3/c12-10-7-14-6-5-9(10)11(15-13)4-3-8-1-2-8/h5-8,11,15H,1-4,13H2.
What are the key properties of [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine?
[1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine has a molecular weight of 225.72 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-4-pyridinyl)-3-cyclopropylpropyl]hydrazine is sourced from PubChem (CID 105315159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).