About 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine
2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine (PubChem CID 113368267) has the molecular formula C14H18N4O
and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine.
Molecular Properties
| Compound Name | 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine |
| PubChem CID | 113368267 |
| Molecular Formula | C14H18N4O |
| Molecular Weight | 258.32 g/mol |
| Exact Mass | 258.15 |
| IUPAC Name | 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine |
| SMILES | COc1ccc(C(C)Nc2ccnc(NN)c2)cc1 |
| InChI | InChI=1S/C14H18N4O/c1-10(11-3-5-13(19-2)6-4-11)17-12-7-8-16-14(9-12)18-15/h3-10H,15H2,1-2H3,(H2,16,17,18) |
| InChIKey | RZBHWCWFQVJIBP-UHFFFAOYSA-N |
| XLogP | 2.55 |
| TPSA | 72.20 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.32 |
| LogP ≤ 5 | 2.55 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 5 |
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 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine?
The IUPAC name of 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine (CID 113368267) is 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine.
What is the SMILES notation for 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine?
The canonical SMILES for 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine is COc1ccc(C(C)Nc2ccnc(NN)c2)cc1.
What is the InChIKey of 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine?
The InChIKey is RZBHWCWFQVJIBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10(11-3-5-13(19-2)6-4-11)17-12-7-8-16-14(9-12)18-15/h3-10H,15H2,1-2H3,(H2,16,17,18).
What are the key properties of 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine?
2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine has a molecular weight of 258.32 g/mol, XLogP of 2.55, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine is sourced from PubChem (CID 113368267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).