4-[(2-methylphenyl)methylideneamino]benzamide

C15H14N2O — CID 969218

IUPAC4-[(2-methylphenyl)methylideneamino]benzamide
SMILESCc1ccccc1/C=N/c1ccc(C(N)=O)cc1
InChIInChI=1S/C15H14N2O/c1-11-4-2-3-5-13(11)10-17-14-8-6-12(7-9-14)15(16)18/h2-10H,1H3,(H2,16,18)/b17-10+
InChIKeyKZZOGXFIFPSRRV-LICLKQGHSA-N
MW238.29 g/mol
LogP2.84
Rot. Bonds3

About 4-[(2-methylphenyl)methylideneamino]benzamide

4-[(2-methylphenyl)methylideneamino]benzamide (PubChem CID 969218) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 4-[(2-methylphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name4-[(2-methylphenyl)methylideneamino]benzamide
PubChem CID969218
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name4-[(2-methylphenyl)methylideneamino]benzamide
SMILESCc1ccccc1/C=N/c1ccc(C(N)=O)cc1
InChIInChI=1S/C15H14N2O/c1-11-4-2-3-5-13(11)10-17-14-8-6-12(7-9-14)15(16)18/h2-10H,1H3,(H2,16,18)/b17-10+
InChIKeyKZZOGXFIFPSRRV-LICLKQGHSA-N
XLogP2.84
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylphenyl)methylideneamino]benzamide?
The IUPAC name of 4-[(2-methylphenyl)methylideneamino]benzamide (CID 969218) is 4-[(2-methylphenyl)methylideneamino]benzamide.
What is the SMILES notation for 4-[(2-methylphenyl)methylideneamino]benzamide?
The canonical SMILES for 4-[(2-methylphenyl)methylideneamino]benzamide is Cc1ccccc1/C=N/c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[(2-methylphenyl)methylideneamino]benzamide?
The InChIKey is KZZOGXFIFPSRRV-LICLKQGHSA-N. The full InChI is InChI=1S/C15H14N2O/c1-11-4-2-3-5-13(11)10-17-14-8-6-12(7-9-14)15(16)18/h2-10H,1H3,(H2,16,18)/b17-10+.
What are the key properties of 4-[(2-methylphenyl)methylideneamino]benzamide?
4-[(2-methylphenyl)methylideneamino]benzamide has a molecular weight of 238.29 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylphenyl)methylideneamino]benzamide is sourced from PubChem (CID 969218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).