2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol

C20H13N3O3 — CID 135497970

IUPAC2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol
SMILESO=[N+]([O-])c1ccc(O)c(/C=N\N=C2c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C20H13N3O3/c24-19-10-9-14(23(25)26)11-13(19)12-21-22-20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1-12,24H/b21-12-
InChIKeyIMVJNWBYQSODKO-MTJSOVHGSA-N
MW343.34 g/mol
LogP4.15
Rot. Bonds3

About 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol

2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol (PubChem CID 135497970) has the molecular formula C20H13N3O3 and a molecular weight of 343.34 g/mol. Its IUPAC name is 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol.

Molecular Properties

Compound Name2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol
PubChem CID135497970
Molecular FormulaC20H13N3O3
Molecular Weight343.34 g/mol
Exact Mass343.10
IUPAC Name2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol
SMILESO=[N+]([O-])c1ccc(O)c(/C=N\N=C2c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C20H13N3O3/c24-19-10-9-14(23(25)26)11-13(19)12-21-22-20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1-12,24H/b21-12-
InChIKeyIMVJNWBYQSODKO-MTJSOVHGSA-N
XLogP4.15
TPSA88.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.34
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(E)-(fluoren-9-ylidenehydrazinylidene)methyl]-2-nitrophenol
CID 135846474
(3E)-3-[(E)-(2-hydroxy-5-nitrophenyl)methylidenehydrazinylidene]-5-methyl-1H-indol-2-one
CID 135949779
(3Z)-3-[(Z)-(2-hydroxy-5-nitrophenyl)methylidenehydrazinylidene]-5-methyl-1H-indol-2-one
CID 135722660
(Z)-N-[(Z)-(2-nitrophenyl)methylideneamino]fluoren-9-imine
CID 5408346
2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]-4-nitrophenol
CID 177498703
(2Z)-2-[(Z)-(2-hydroxy-5-nitrophenyl)methylidenehydrazinylidene]-1,2-diphenylethanone
CID 135775343
2-[(Z)-(2-hydroxy-5-nitrophenyl)methylideneamino]-1-nitroguanidine
CID 136693031
3-hydroxy-N-[(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide
CID 3101754
(15R,19R)-17-[(Z)-(2-hydroxy-5-nitrophenyl)methylideneamino]-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
CID 137076735
2-hydroxy-N-[(2-hydroxy-5-nitrophenyl)methylideneamino]-5-nitrobenzamide
CID 3358963
1-(dihydroxyamino)-2-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]guanidine
CID 135822056
N-[(2-hydroxy-5-nitrophenyl)methylideneamino]benzenesulfonamide
CID 3807440

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol?
The IUPAC name of 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol (CID 135497970) is 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol.
What is the SMILES notation for 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol?
The canonical SMILES for 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol is O=[N+]([O-])c1ccc(O)c(/C=N\N=C2c3ccccc3-c3ccccc32)c1.
What is the InChIKey of 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol?
The InChIKey is IMVJNWBYQSODKO-MTJSOVHGSA-N. The full InChI is InChI=1S/C20H13N3O3/c24-19-10-9-14(23(25)26)11-13(19)12-21-22-20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1-12,24H/b21-12-.
What are the key properties of 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol?
2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol has a molecular weight of 343.34 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4-nitrophenol is sourced from PubChem (CID 135497970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).