N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine

C14H12FNO2 — CID 808278

IUPACN-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine
SMILESON=Cc1ccccc1OCc1ccccc1F
InChIInChI=1S/C14H12FNO2/c15-13-7-3-1-6-12(13)10-18-14-8-4-2-5-11(14)9-16-17/h1-9,17H,10H2
InChIKeyNVNWFMDMGZSJLR-UHFFFAOYSA-N
MW245.25 g/mol
LogP3.21
Rot. Bonds4

About N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine

N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine (PubChem CID 808278) has the molecular formula C14H12FNO2 and a molecular weight of 245.25 g/mol. Its IUPAC name is N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine.

Molecular Properties

Compound NameN-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine
PubChem CID808278
Molecular FormulaC14H12FNO2
Molecular Weight245.25 g/mol
Exact Mass245.09
IUPAC NameN-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine
SMILESON=Cc1ccccc1OCc1ccccc1F
InChIInChI=1S/C14H12FNO2/c15-13-7-3-1-6-12(13)10-18-14-8-4-2-5-11(14)9-16-17/h1-9,17H,10H2
InChIKeyNVNWFMDMGZSJLR-UHFFFAOYSA-N
XLogP3.21
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine?
The IUPAC name of N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine (CID 808278) is N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine.
What is the SMILES notation for N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine?
The canonical SMILES for N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine is ON=Cc1ccccc1OCc1ccccc1F.
What is the InChIKey of N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine?
The InChIKey is NVNWFMDMGZSJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO2/c15-13-7-3-1-6-12(13)10-18-14-8-4-2-5-11(14)9-16-17/h1-9,17H,10H2.
What are the key properties of N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine?
N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine has a molecular weight of 245.25 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine is sourced from PubChem (CID 808278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).