N-(3-cyanophenyl)-2-hydrazinylbenzamide

C14H12N4O — CID 62248854

IUPACN-(3-cyanophenyl)-2-hydrazinylbenzamide
SMILESN#Cc1cccc(NC(=O)c2ccccc2NN)c1
InChIInChI=1S/C14H12N4O/c15-9-10-4-3-5-11(8-10)17-14(19)12-6-1-2-7-13(12)18-16/h1-8,18H,16H2,(H,17,19)
InChIKeyBOSGGFXWZYOJDL-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.10
Rot. Bonds3

About N-(3-cyanophenyl)-2-hydrazinylbenzamide

N-(3-cyanophenyl)-2-hydrazinylbenzamide (PubChem CID 62248854) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is N-(3-cyanophenyl)-2-hydrazinylbenzamide.

Molecular Properties

Compound NameN-(3-cyanophenyl)-2-hydrazinylbenzamide
PubChem CID62248854
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC NameN-(3-cyanophenyl)-2-hydrazinylbenzamide
SMILESN#Cc1cccc(NC(=O)c2ccccc2NN)c1
InChIInChI=1S/C14H12N4O/c15-9-10-4-3-5-11(8-10)17-14(19)12-6-1-2-7-13(12)18-16/h1-8,18H,16H2,(H,17,19)
InChIKeyBOSGGFXWZYOJDL-UHFFFAOYSA-N
XLogP2.10
TPSA90.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-cyanophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]benzamide
CID 100779207
2-hydrazinyl-N-phenylbenzamide
CID 12569370
2-(2-amino-2-oxoethoxy)-N-(3-cyanophenyl)benzamide
CID 34795688
2-chloro-N-(3-cyanophenyl)-3-fluorobenzamide
CID 79035948
N-(3-cyanophenyl)-2-methoxypyridine-3-carboxamide
CID 55023858
2,5-dibromo-N-(3-cyanophenyl)benzamide
CID 114369410
2-bromo-N-[4-(3-cyanoanilino)phenyl]benzamide
CID 112989936
5-amino-2,3-dichloro-N-(3-cyanophenyl)benzamide
CID 107183181
N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide
CID 24706951
1-(3-cyanophenyl)-3-[3-[(3-cyanophenyl)carbamoylamino]phenyl]urea
CID 11101346
N-(3-cyanophenyl)-4-[4-[(3-cyanophenyl)carbamoyl]phenyl]benzamide
CID 90213286
N-(3-cyanophenyl)-2-[2-(2-fluoroanilino)-2-oxoethoxy]benzamide
CID 26727992

Frequently Asked Questions

What is the IUPAC name of N-(3-cyanophenyl)-2-hydrazinylbenzamide?
The IUPAC name of N-(3-cyanophenyl)-2-hydrazinylbenzamide (CID 62248854) is N-(3-cyanophenyl)-2-hydrazinylbenzamide.
What is the SMILES notation for N-(3-cyanophenyl)-2-hydrazinylbenzamide?
The canonical SMILES for N-(3-cyanophenyl)-2-hydrazinylbenzamide is N#Cc1cccc(NC(=O)c2ccccc2NN)c1.
What is the InChIKey of N-(3-cyanophenyl)-2-hydrazinylbenzamide?
The InChIKey is BOSGGFXWZYOJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c15-9-10-4-3-5-11(8-10)17-14(19)12-6-1-2-7-13(12)18-16/h1-8,18H,16H2,(H,17,19).
What are the key properties of N-(3-cyanophenyl)-2-hydrazinylbenzamide?
N-(3-cyanophenyl)-2-hydrazinylbenzamide has a molecular weight of 252.28 g/mol, XLogP of 2.10, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyanophenyl)-2-hydrazinylbenzamide is sourced from PubChem (CID 62248854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).