2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide

C15H15FN2O2 — CID 24692353

IUPAC2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide
SMILESN/C(Cc1ccc(OCc2ccc(F)cc2)cc1)=N\O
InChIInChI=1S/C15H15FN2O2/c16-13-5-1-12(2-6-13)10-20-14-7-3-11(4-8-14)9-15(17)18-19/h1-8,19H,9-10H2,(H2,17,18)
InChIKeyDSMHKAXDDNIIOD-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.69
Rot. Bonds5

About 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide

2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide (PubChem CID 24692353) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide
PubChem CID24692353
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide
SMILESN/C(Cc1ccc(OCc2ccc(F)cc2)cc1)=N\O
InChIInChI=1S/C15H15FN2O2/c16-13-5-1-12(2-6-13)10-20-14-7-3-11(4-8-14)9-15(17)18-19/h1-8,19H,9-10H2,(H2,17,18)
InChIKeyDSMHKAXDDNIIOD-UHFFFAOYSA-N
XLogP2.69
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[4-[(5-fluoro-2-methylphenyl)methoxy]phenyl]-N'-hydroxyethanimidamide
CID 105371860
2-[4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide
CID 114849592
2-chloro-N'-[4-[(4-fluorophenyl)methoxy]phenyl]ethanimidamide
CID 169368086
1-fluoro-4-[[4-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]phenyl]methoxy]benzene
CID 129203352
N'-hydroxy-2-[4-(pyridin-2-ylmethoxy)phenyl]ethanimidamide
CID 24703645
3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide
CID 91686884
1-(chloromethyl)-4-[(4-fluorophenyl)methoxy]benzene
CID 22280023
1-fluoro-4-(phenoxymethyl)benzene
CID 957495
1-azido-4-[(4-fluorophenyl)methoxy]benzene
CID 150502855
2-amino-3-[4-[(4-fluorophenyl)methoxy]phenyl]propan-1-ol
CID 170892261
4-[(4-fluorophenyl)methoxy]benzenesulfonamide
CID 43342474
(1R)-1-[4-[(4-fluorophenyl)methoxy]phenyl]ethanol
CID 63364366

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide (CID 24692353) is 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide is N/C(Cc1ccc(OCc2ccc(F)cc2)cc1)=N\O.
What is the InChIKey of 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide?
The InChIKey is DSMHKAXDDNIIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c16-13-5-1-12(2-6-13)10-20-14-7-3-11(4-8-14)9-15(17)18-19/h1-8,19H,9-10H2,(H2,17,18).
What are the key properties of 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide?
2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide has a molecular weight of 274.30 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide is sourced from PubChem (CID 24692353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).