[2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine

C14H12F2N2O — CID 168529477

IUPAC[2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine
SMILESNN=Cc1ccccc1COc1cc(F)cc(F)c1
InChIInChI=1S/C14H12F2N2O/c15-12-5-13(16)7-14(6-12)19-9-11-4-2-1-3-10(11)8-18-17/h1-8H,9,17H2
InChIKeyLKFFAFPPPXGASL-UHFFFAOYSA-N
MW262.26 g/mol
LogP2.84
Rot. Bonds4

About [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine

[2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine (PubChem CID 168529477) has the molecular formula C14H12F2N2O and a molecular weight of 262.26 g/mol. Its IUPAC name is [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine.

Molecular Properties

Compound Name[2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine
PubChem CID168529477
Molecular FormulaC14H12F2N2O
Molecular Weight262.26 g/mol
Exact Mass262.09
IUPAC Name[2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine
SMILESNN=Cc1ccccc1COc1cc(F)cc(F)c1
InChIInChI=1S/C14H12F2N2O/c15-12-5-13(16)7-14(6-12)19-9-11-4-2-1-3-10(11)8-18-17/h1-8H,9,17H2
InChIKeyLKFFAFPPPXGASL-UHFFFAOYSA-N
XLogP2.84
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine
CID 168529363
2-[(3,5-difluorophenoxy)methyl]benzenecarbothioamide
CID 62783746
[[2-[(3,4,5-trifluorophenoxy)methyl]phenyl]methylideneamino]thiourea
CID 168534625
[[2-[(4-fluorophenoxy)methyl]phenyl]methylideneamino]thiourea
CID 168534550
[2-[(3-fluorophenyl)methoxy]phenyl]methylidenehydrazine
CID 168529846
3-[(2-chlorophenyl)methoxy]-5-fluoroaniline
CID 80752307
[2-(cyclopropylmethoxymethyl)phenyl]methylidenehydrazine
CID 168529536
2-[(3,5-difluorophenoxy)methyl]-4-fluoroaniline
CID 62786342
[2-[(3,5-difluorophenyl)methoxy]-4-fluorophenyl]methylidenehydrazine
CID 168529513
2-[[2-(phenoxymethyl)phenyl]methylideneamino]guanidine
CID 168591467
2-[[2-[(2,4-difluorophenoxy)methyl]phenyl]methylideneamino]guanidine
CID 168590822
2-[(3-bromo-5-fluorophenoxy)methyl]-N'-hydroxybenzenecarboximidamide
CID 81332303

Frequently Asked Questions

What is the IUPAC name of [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine?
The IUPAC name of [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine (CID 168529477) is [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine.
What is the SMILES notation for [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine?
The canonical SMILES for [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine is NN=Cc1ccccc1COc1cc(F)cc(F)c1.
What is the InChIKey of [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine?
The InChIKey is LKFFAFPPPXGASL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O/c15-12-5-13(16)7-14(6-12)19-9-11-4-2-1-3-10(11)8-18-17/h1-8H,9,17H2.
What are the key properties of [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine?
[2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine has a molecular weight of 262.26 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3,5-difluorophenoxy)methyl]phenyl]methylidenehydrazine is sourced from PubChem (CID 168529477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).