[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea

C15H14FN3O2 — CID 71670043

IUPAC[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea
SMILESNC(=O)N/N=C\c1ccccc1OCc1ccccc1F
InChIInChI=1S/C15H14FN3O2/c16-13-7-3-1-6-12(13)10-21-14-8-4-2-5-11(14)9-18-19-15(17)20/h1-9H,10H2,(H3,17,19,20)/b18-9-
InChIKeyJOGPHLZJNSIYRM-NVMNQCDNSA-N
MW287.29 g/mol
LogP2.41
Rot. Bonds5

About [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea

[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea (PubChem CID 71670043) has the molecular formula C15H14FN3O2 and a molecular weight of 287.29 g/mol. Its IUPAC name is [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea.

Molecular Properties

Compound Name[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea
PubChem CID71670043
Molecular FormulaC15H14FN3O2
Molecular Weight287.29 g/mol
Exact Mass287.11
IUPAC Name[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea
SMILESNC(=O)N/N=C\c1ccccc1OCc1ccccc1F
InChIInChI=1S/C15H14FN3O2/c16-13-7-3-1-6-12(13)10-21-14-8-4-2-5-11(14)9-18-19-15(17)20/h1-9H,10H2,(H3,17,19,20)/b18-9-
InChIKeyJOGPHLZJNSIYRM-NVMNQCDNSA-N
XLogP2.41
TPSA76.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-fluorophenyl)-N'-[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]oxamide
CID 8930437
[(Z)-[2-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methylideneamino]urea
CID 126087766
[(E)-[4-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea
CID 6872564
N'-[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]-N-(2-methylpropyl)oxamide
CID 8930390
[(Z)-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]urea
CID 5426340
(NZ)-N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine
CID 5408745
N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]aniline
CID 169382467
2-[(E)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]guanidine
CID 97312635
N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]-2-morpholin-4-ylacetamide
CID 1231188
N-[(E)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]-3-methoxy-4-prop-2-enoxybenzamide
CID 126316627
3-ethoxy-N-[(E)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]-4-phenylmethoxybenzamide
CID 126322808
[(E)-[2-[[2,4,5-tris[[2-[(E)-(carbamothioylhydrazinylidene)methyl]phenoxy]methyl]phenyl]methoxy]phenyl]methylideneamino]thiourea
CID 139236029

Frequently Asked Questions

What is the IUPAC name of [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea?
The IUPAC name of [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea (CID 71670043) is [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea.
What is the SMILES notation for [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea?
The canonical SMILES for [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea is NC(=O)N/N=C\c1ccccc1OCc1ccccc1F.
What is the InChIKey of [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea?
The InChIKey is JOGPHLZJNSIYRM-NVMNQCDNSA-N. The full InChI is InChI=1S/C15H14FN3O2/c16-13-7-3-1-6-12(13)10-21-14-8-4-2-5-11(14)9-18-19-15(17)20/h1-9H,10H2,(H3,17,19,20)/b18-9-.
What are the key properties of [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea?
[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea has a molecular weight of 287.29 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea is sourced from PubChem (CID 71670043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).