2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide

C22H15N3O2 — CID 9467609

IUPAC2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide
SMILESN#Cc1ccccc1OCC(=O)NN=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C22H15N3O2/c23-13-15-7-1-6-12-20(15)27-14-21(26)24-25-22-18-10-4-2-8-16(18)17-9-3-5-11-19(17)22/h1-12H,14H2,(H,24,26)
InChIKeyVCRDROVTGWDIJP-UHFFFAOYSA-N
MW353.38 g/mol
LogP3.49
Rot. Bonds4

About 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide

2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide (PubChem CID 9467609) has the molecular formula C22H15N3O2 and a molecular weight of 353.38 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide
PubChem CID9467609
Molecular FormulaC22H15N3O2
Molecular Weight353.38 g/mol
Exact Mass353.12
IUPAC Name2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide
SMILESN#Cc1ccccc1OCC(=O)NN=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C22H15N3O2/c23-13-15-7-1-6-12-20(15)27-14-21(26)24-25-22-18-10-4-2-8-16(18)17-9-3-5-11-19(17)22/h1-12H,14H2,(H,24,26)
InChIKeyVCRDROVTGWDIJP-UHFFFAOYSA-N
XLogP3.49
TPSA74.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 53.49
H-Bond Donors ≤ 51
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

2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide
CID 9316575
2-(2-cyanophenoxy)-N-[(4-methylcyclohexylidene)amino]acetamide
CID 9467608
N-(benzylideneamino)-2-(2-cyanophenoxy)acetamide
CID 789568
2-(2-cyanophenoxy)-N-(1-phenylethylideneamino)acetamide
CID 766684
2-(2-cyanophenoxy)-N-(heptan-4-ylideneamino)acetamide
CID 9467595
2-(2-cyanophenoxy)-N-[(E)-[3-[(E)-[[2-(2-cyanophenoxy)acetyl]hydrazinylidene]methyl]phenyl]methylideneamino]acetamide
CID 42995701
2-(2-cyanophenoxy)-N-(2-phenylphenyl)acetamide
CID 7696058
N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2-(2-cyanophenoxy)acetamide
CID 9467674
N-tert-butyl-2-(2-cyanophenoxy)acetamide
CID 2565352
2-(2-cyanophenoxy)-N-[(Z)-(6-fluoro-2,3-dihydrothiochromen-4-ylidene)amino]acetamide
CID 9467470
4-[[[2-(2-cyanophenoxy)acetyl]hydrazinylidene]methyl]benzoic acid
CID 110209219
2-(2-cyanophenoxy)-N-[(2,6-dichlorophenyl)methylideneamino]acetamide
CID 780706

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide (CID 9467609) is 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide is N#Cc1ccccc1OCC(=O)NN=C1c2ccccc2-c2ccccc21.
What is the InChIKey of 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide?
The InChIKey is VCRDROVTGWDIJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N3O2/c23-13-15-7-1-6-12-20(15)27-14-21(26)24-25-22-18-10-4-2-8-16(18)17-9-3-5-11-19(17)22/h1-12H,14H2,(H,24,26).
What are the key properties of 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide?
2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide has a molecular weight of 353.38 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide is sourced from PubChem (CID 9467609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).