1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine

C16H12F4N2O2 — CID 2341684

IUPAC1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine
SMILESFC(F)Oc1ccccc1C=NN=Cc1ccccc1OC(F)F
InChIInChI=1S/C16H12F4N2O2/c17-15(18)23-13-7-3-1-5-11(13)9-21-22-10-12-6-2-4-8-14(12)24-16(19)20/h1-10,15-16H
InChIKeyWUKJRBAAXBDPDV-UHFFFAOYSA-N
MW340.28 g/mol
LogP4.34
Rot. Bonds7

About 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine

1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine (PubChem CID 2341684) has the molecular formula C16H12F4N2O2 and a molecular weight of 340.28 g/mol. Its IUPAC name is 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine.

Molecular Properties

Compound Name1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine
PubChem CID2341684
Molecular FormulaC16H12F4N2O2
Molecular Weight340.28 g/mol
Exact Mass340.08
IUPAC Name1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine
SMILESFC(F)Oc1ccccc1C=NN=Cc1ccccc1OC(F)F
InChIInChI=1S/C16H12F4N2O2/c17-15(18)23-13-7-3-1-5-11(13)9-21-22-10-12-6-2-4-8-14(12)24-16(19)20/h1-10,15-16H
InChIKeyWUKJRBAAXBDPDV-UHFFFAOYSA-N
XLogP4.34
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.28
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

(2E)-2-[(E)-[2-(difluoromethoxy)phenyl]methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 135634727
(2Z)-2-[(Z)-[2-(difluoromethoxy)phenyl]methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 135558880
2-chloro-N-[[2-(difluoromethoxy)phenyl]methylideneamino]aniline
CID 4612061
4-chloro-N-[[2-(difluoromethoxy)phenyl]methylideneamino]benzamide
CID 2691883
2-[(E)-[2-(difluoromethoxy)phenyl]methylidenehydrazinylidene]-5-methyl-1,3-thiazolidin-4-one
CID 172942203
2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide
CID 18292189
3-[2-(difluoromethoxy)phenyl]prop-2-ene-1-thiol
CID 169455478
(Z)-1-[2-(difluoromethoxy)phenyl]-N-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanimine
CID 6598140
(E)-4-[2-(difluoromethoxy)phenyl]but-3-en-2-amine
CID 103091591
1-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]-3-ethylthiourea
CID 6301268
3-[2-(difluoromethoxy)phenyl]prop-2-enamide
CID 169482051
[2-(difluoromethoxy)phenyl]methylidene-hydroxy-methyl-oxo-λ6-sulfane
CID 91805708

Frequently Asked Questions

What is the IUPAC name of 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine?
The IUPAC name of 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine (CID 2341684) is 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine.
What is the SMILES notation for 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine?
The canonical SMILES for 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine is FC(F)Oc1ccccc1C=NN=Cc1ccccc1OC(F)F.
What is the InChIKey of 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine?
The InChIKey is WUKJRBAAXBDPDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F4N2O2/c17-15(18)23-13-7-3-1-5-11(13)9-21-22-10-12-6-2-4-8-14(12)24-16(19)20/h1-10,15-16H.
What are the key properties of 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine?
1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine has a molecular weight of 340.28 g/mol, XLogP of 4.34, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(difluoromethoxy)phenyl]-N-[[2-(difluoromethoxy)phenyl]methylideneamino]methanimine is sourced from PubChem (CID 2341684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).