(Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine

C20H13N3O2 — CID 5408346

IUPAC(Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine
SMILESO=[N+]([O-])c1ccccc1/C=N\N=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C20H13N3O2/c24-23(25)19-12-6-1-7-14(19)13-21-22-20-17-10-4-2-8-15(17)16-9-3-5-11-18(16)20/h1-13H/b21-13-
InChIKeyFEEMILDFBAPGGL-BKUYFWCQSA-N
MW327.34 g/mol
LogP4.45
Rot. Bonds3

About (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine

(Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine (PubChem CID 5408346) has the molecular formula C20H13N3O2 and a molecular weight of 327.34 g/mol. Its IUPAC name is (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine.

Molecular Properties

Compound Name(Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine
PubChem CID5408346
Molecular FormulaC20H13N3O2
Molecular Weight327.34 g/mol
Exact Mass327.10
IUPAC Name(Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine
SMILESO=[N+]([O-])c1ccccc1/C=N\N=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C20H13N3O2/c24-23(25)19-12-6-1-7-14(19)13-21-22-20-17-10-4-2-8-15(17)16-9-3-5-11-18(16)20/h1-13H/b21-13-
InChIKeyFEEMILDFBAPGGL-BKUYFWCQSA-N
XLogP4.45
TPSA67.86 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol
CID 135497970
4-[(E)-(fluoren-9-ylidenehydrazinylidene)methyl]-2-nitrophenol
CID 135846474
2-[(2-nitrophenyl)methylidene]indene-1,3-dione
CID 616194
N-methyl-N-[(2-nitrophenyl)methylideneamino]methanamine
CID 78408891
(Z)-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]-1-(2-nitrophenyl)methanimine
CID 6435289
(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-(2-nitrophenyl)methanimine
CID 5351051
[2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]phenyl]methanediol
CID 130198257
N-[(2-nitrophenyl)methylideneamino]formamide
CID 2795189
[(2-nitrophenyl)methylideneamino](13C)urea
CID 57370038
[(E)-[2-[oxido(oxo)(15N)(15N)azaniumyl]phenyl](113C)methylideneamino]urea
CID 155903854
3-(2-nitrophenyl)-N-[3-(2-nitrophenyl)prop-2-enylideneamino]prop-2-en-1-imine
CID 4665830
sodium 2-nitrobenzaldehyde
CID 23669302

Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine?
The IUPAC name of (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine (CID 5408346) is (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine.
What is the SMILES notation for (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine?
The canonical SMILES for (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine is O=[N+]([O-])c1ccccc1/C=N\N=C1c2ccccc2-c2ccccc21.
What is the InChIKey of (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine?
The InChIKey is FEEMILDFBAPGGL-BKUYFWCQSA-N. The full InChI is InChI=1S/C20H13N3O2/c24-23(25)19-12-6-1-7-14(19)13-21-22-20-17-10-4-2-8-15(17)16-9-3-5-11-18(16)20/h1-13H/b21-13-.
What are the key properties of (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine?
(Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine has a molecular weight of 327.34 g/mol, XLogP of 4.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine is sourced from PubChem (CID 5408346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).