N'-(3-methylphenyl)benzohydrazide

C14H14N2O — CID 2812383

IUPACN'-(3-methylphenyl)benzohydrazide
SMILESCc1cccc(NNC(=O)c2ccccc2)c1
InChIInChI=1S/C14H14N2O/c1-11-6-5-9-13(10-11)15-16-14(17)12-7-3-2-4-8-12/h2-10,15H,1H3,(H,16,17)
InChIKeyUMIBNWHWLJMMAJ-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.75
Rot. Bonds3

About N'-(3-methylphenyl)benzohydrazide

N'-(3-methylphenyl)benzohydrazide (PubChem CID 2812383) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is N'-(3-methylphenyl)benzohydrazide.

Molecular Properties

Compound NameN'-(3-methylphenyl)benzohydrazide
PubChem CID2812383
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC NameN'-(3-methylphenyl)benzohydrazide
SMILESCc1cccc(NNC(=O)c2ccccc2)c1
InChIInChI=1S/C14H14N2O/c1-11-6-5-9-13(10-11)15-16-14(17)12-7-3-2-4-8-12/h2-10,15H,1H3,(H,16,17)
InChIKeyUMIBNWHWLJMMAJ-UHFFFAOYSA-N
XLogP2.75
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(3-methylphenyl)benzohydrazide?
The IUPAC name of N'-(3-methylphenyl)benzohydrazide (CID 2812383) is N'-(3-methylphenyl)benzohydrazide.
What is the SMILES notation for N'-(3-methylphenyl)benzohydrazide?
The canonical SMILES for N'-(3-methylphenyl)benzohydrazide is Cc1cccc(NNC(=O)c2ccccc2)c1.
What is the InChIKey of N'-(3-methylphenyl)benzohydrazide?
The InChIKey is UMIBNWHWLJMMAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-11-6-5-9-13(10-11)15-16-14(17)12-7-3-2-4-8-12/h2-10,15H,1H3,(H,16,17).
What are the key properties of N'-(3-methylphenyl)benzohydrazide?
N'-(3-methylphenyl)benzohydrazide has a molecular weight of 226.28 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-methylphenyl)benzohydrazide is sourced from PubChem (CID 2812383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).