2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide

C22H15N3O2 — CID 9316575

IUPAC2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide
SMILESN#Cc1ccc(OCC(=O)NN=C2c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C22H15N3O2/c23-13-15-9-11-16(12-10-15)27-14-21(26)24-25-22-19-7-3-1-5-17(19)18-6-2-4-8-20(18)22/h1-12H,14H2,(H,24,26)
InChIKeyOZCIKXGECQLODV-UHFFFAOYSA-N
MW353.38 g/mol
LogP3.49
Rot. Bonds4

About 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide

2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide (PubChem CID 9316575) has the molecular formula C22H15N3O2 and a molecular weight of 353.38 g/mol. Its IUPAC name is 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide.

Molecular Properties

Compound Name2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide
PubChem CID9316575
Molecular FormulaC22H15N3O2
Molecular Weight353.38 g/mol
Exact Mass353.12
IUPAC Name2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide
SMILESN#Cc1ccc(OCC(=O)NN=C2c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C22H15N3O2/c23-13-15-9-11-16(12-10-15)27-14-21(26)24-25-22-19-7-3-1-5-17(19)18-6-2-4-8-20(18)22/h1-12H,14H2,(H,24,26)
InChIKeyOZCIKXGECQLODV-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-(2-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide
CID 9467609
2-(4-cyanophenoxy)-N-(pentan-3-ylideneamino)acetamide
CID 4082940
N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2-(4-cyanophenoxy)acetamide
CID 9316593
N-(butan-2-ylideneamino)-2-(4-cyanophenoxy)acetamide
CID 3686210
N-[(Z)-anthracen-9-ylmethylideneamino]-2-(4-cyanophenoxy)acetamide
CID 9316542
N-[(E)-(2-bromophenyl)methylideneamino]-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 42992144
2-(4-cyanophenoxy)-N-[(Z)-[(5S)-3,3,5-trimethylcyclohexylidene]amino]acetamide
CID 9316535
N'-[2-(4-cyanophenoxy)acetyl]-4-(1,3-dioxoisoindol-2-yl)butanehydrazide
CID 2372181
2-(4-cyanophenoxy)-N-[(Z)-1-(furan-2-yl)ethylideneamino]acetamide
CID 6378395
2-(4-cyanophenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 2711808
2-(4-cyanophenoxy)-N-(1,1-diphenylethyl)acetamide
CID 56522927
N-[(Z)-(4-cyanophenyl)methylideneamino]-2-(4-iodophenoxy)acetamide
CID 7326687

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide?
The IUPAC name of 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide (CID 9316575) is 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide.
What is the SMILES notation for 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide?
The canonical SMILES for 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide is N#Cc1ccc(OCC(=O)NN=C2c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide?
The InChIKey is OZCIKXGECQLODV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N3O2/c23-13-15-9-11-16(12-10-15)27-14-21(26)24-25-22-19-7-3-1-5-17(19)18-6-2-4-8-20(18)22/h1-12H,14H2,(H,24,26).
What are the key properties of 2-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide?
2-(4-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-(4-cyanophenoxy)-N-(fluoren-9-ylideneamino)acetamide is sourced from PubChem (CID 9316575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).