N-(fluoren-9-ylideneamino)benzamide

C20H14N2O — CID 794021

IUPACN-(fluoren-9-ylideneamino)benzamide
SMILESO=C(NN=C1c2ccccc2-c2ccccc21)c1ccccc1
InChIInChI=1S/C20H14N2O/c23-20(14-8-2-1-3-9-14)22-21-19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13H,(H,22,23)
InChIKeyXPLYMCMLTSOSBQ-UHFFFAOYSA-N
MW298.35 g/mol
LogP3.85
Rot. Bonds2

About N-(fluoren-9-ylideneamino)benzamide

N-(fluoren-9-ylideneamino)benzamide (PubChem CID 794021) has the molecular formula C20H14N2O and a molecular weight of 298.35 g/mol. Its IUPAC name is N-(fluoren-9-ylideneamino)benzamide.

Molecular Properties

Compound NameN-(fluoren-9-ylideneamino)benzamide
PubChem CID794021
Molecular FormulaC20H14N2O
Molecular Weight298.35 g/mol
Exact Mass298.11
IUPAC NameN-(fluoren-9-ylideneamino)benzamide
SMILESO=C(NN=C1c2ccccc2-c2ccccc21)c1ccccc1
InChIInChI=1S/C20H14N2O/c23-20(14-8-2-1-3-9-14)22-21-19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13H,(H,22,23)
InChIKeyXPLYMCMLTSOSBQ-UHFFFAOYSA-N
XLogP3.85
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'keto_phenone_zone_A(2)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(fluoren-9-ylideneamino)benzamide?
The IUPAC name of N-(fluoren-9-ylideneamino)benzamide (CID 794021) is N-(fluoren-9-ylideneamino)benzamide.
What is the SMILES notation for N-(fluoren-9-ylideneamino)benzamide?
The canonical SMILES for N-(fluoren-9-ylideneamino)benzamide is O=C(NN=C1c2ccccc2-c2ccccc21)c1ccccc1.
What is the InChIKey of N-(fluoren-9-ylideneamino)benzamide?
The InChIKey is XPLYMCMLTSOSBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O/c23-20(14-8-2-1-3-9-14)22-21-19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13H,(H,22,23).
What are the key properties of N-(fluoren-9-ylideneamino)benzamide?
N-(fluoren-9-ylideneamino)benzamide has a molecular weight of 298.35 g/mol, XLogP of 3.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(fluoren-9-ylideneamino)benzamide is sourced from PubChem (CID 794021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).