4-cyano-N,N'-diphenylbenzohydrazide

C20H15N3O — CID 11301448

IUPAC4-cyano-N,N'-diphenylbenzohydrazide
SMILESN#Cc1ccc(C(=O)N(Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H15N3O/c21-15-16-11-13-17(14-12-16)20(24)23(19-9-5-2-6-10-19)22-18-7-3-1-4-8-18/h1-14,22H
InChIKeyZRRORQACLSTORX-UHFFFAOYSA-N
MW313.36 g/mol
LogP4.23
Rot. Bonds4

About 4-cyano-N,N'-diphenylbenzohydrazide

4-cyano-N,N'-diphenylbenzohydrazide (PubChem CID 11301448) has the molecular formula C20H15N3O and a molecular weight of 313.36 g/mol. Its IUPAC name is 4-cyano-N,N'-diphenylbenzohydrazide.

Molecular Properties

Compound Name4-cyano-N,N'-diphenylbenzohydrazide
PubChem CID11301448
Molecular FormulaC20H15N3O
Molecular Weight313.36 g/mol
Exact Mass313.12
IUPAC Name4-cyano-N,N'-diphenylbenzohydrazide
SMILESN#Cc1ccc(C(=O)N(Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H15N3O/c21-15-16-11-13-17(14-12-16)20(24)23(19-9-5-2-6-10-19)22-18-7-3-1-4-8-18/h1-14,22H
InChIKeyZRRORQACLSTORX-UHFFFAOYSA-N
XLogP4.23
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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4-[2-(N-methylanilino)acetyl]benzonitrile
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N-benzyl-4-cyano(111C)cyclohexa-1,3,5-triene-1-carboxamide
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1-N-(3-cyanophenyl)-4-N-ethyl-4-N-phenylbenzene-1,4-dicarboxamide
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2-(N-anilinoanilino)benzene-1,3,5-tricarbonitrile
CID 66638685
N-benzyl-4-cyano-N-[3-[2-(3-methylanilino)-2-oxoethyl]phenyl]benzamide
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N-(3-aminophenyl)-4-cyano-N-ethylbenzamide
CID 63229875
N-(4-cyanophenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
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4-[(3-oxo-3-phenylpropyl)amino]benzonitrile
CID 94268936
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2-(4-cyanophenyl)-N-phenylacetamide
CID 12672919

Frequently Asked Questions

What is the IUPAC name of 4-cyano-N,N'-diphenylbenzohydrazide?
The IUPAC name of 4-cyano-N,N'-diphenylbenzohydrazide (CID 11301448) is 4-cyano-N,N'-diphenylbenzohydrazide.
What is the SMILES notation for 4-cyano-N,N'-diphenylbenzohydrazide?
The canonical SMILES for 4-cyano-N,N'-diphenylbenzohydrazide is N#Cc1ccc(C(=O)N(Nc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-cyano-N,N'-diphenylbenzohydrazide?
The InChIKey is ZRRORQACLSTORX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O/c21-15-16-11-13-17(14-12-16)20(24)23(19-9-5-2-6-10-19)22-18-7-3-1-4-8-18/h1-14,22H.
What are the key properties of 4-cyano-N,N'-diphenylbenzohydrazide?
4-cyano-N,N'-diphenylbenzohydrazide has a molecular weight of 313.36 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-N,N'-diphenylbenzohydrazide is sourced from PubChem (CID 11301448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).