About (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine
(NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine (PubChem CID 103046778) has the molecular formula C15H13ClFNO2
and a molecular weight of 293.73 g/mol. Its IUPAC name is (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine.
Molecular Properties
| Compound Name | (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine |
| PubChem CID | 103046778 |
| Molecular Formula | C15H13ClFNO2 |
| Molecular Weight | 293.73 g/mol |
| Exact Mass | 293.06 |
| IUPAC Name | (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine |
| SMILES | C/C(=N/O)c1ccccc1OCc1cc(Cl)ccc1F |
| InChI | InChI=1S/C15H13ClFNO2/c1-10(18-19)13-4-2-3-5-15(13)20-9-11-8-12(16)6-7-14(11)17/h2-8,19H,9H2,1H3/b18-10- |
| InChIKey | SSABYUZYOKSBQY-ZDLGFXPLSA-N |
| XLogP | 4.26 |
| TPSA | 41.82 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 293.73 |
| LogP ≤ 5 | 4.26 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', '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 (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine (CID 103046778) is (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine is C/C(=N/O)c1ccccc1OCc1cc(Cl)ccc1F.
What is the InChIKey of (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine?
The InChIKey is SSABYUZYOKSBQY-ZDLGFXPLSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c1-10(18-19)13-4-2-3-5-15(13)20-9-11-8-12(16)6-7-14(11)17/h2-8,19H,9H2,1H3/b18-10-.
What are the key properties of (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine?
(NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine has a molecular weight of 293.73 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethylidene]hydroxylamine is sourced from PubChem (CID 103046778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).