N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide

C15H14N2O2 — CID 135459102

IUPACN-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide
SMILESCc1ccc(C(=O)N/N=C/c2ccccc2O)cc1
InChIInChI=1S/C15H14N2O2/c1-11-6-8-12(9-7-11)15(19)17-16-10-13-4-2-3-5-14(13)18/h2-10,18H,1H3,(H,17,19)/b16-10+
InChIKeyDPUVCYHYDOCXKP-MHWRWJLKSA-N
MW254.29 g/mol
LogP2.46
Rot. Bonds3

About N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide

N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide (PubChem CID 135459102) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide.

Molecular Properties

Compound NameN-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide
PubChem CID135459102
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC NameN-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide
SMILESCc1ccc(C(=O)N/N=C/c2ccccc2O)cc1
InChIInChI=1S/C15H14N2O2/c1-11-6-8-12(9-7-11)15(19)17-16-10-13-4-2-3-5-14(13)18/h2-10,18H,1H3,(H,17,19)/b16-10+
InChIKeyDPUVCYHYDOCXKP-MHWRWJLKSA-N
XLogP2.46
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Chel 180
CID 135445765
Benzoic (2-methoxybenzylidene)hydrazide
CID 9554484
Gsk 4716
CID 5331325
(2-Hydroxybenzylidene)salicylohydrazide
CID 135484660
4-Hydroxybenzoic (2-hydroxybenzylidene)hydrazide
CID 135778696
2-hydroxy-N'-(2-hydroxybenzyl)benzohydrazide
CID 392123
N'-[(E)-(4-methoxyphenyl)methylidene]benzohydrazide
CID 6861535
2-Hydroxy-N'-[(E)-(3-hydroxyphenyl)methylidene]benzohydrazide
CID 6893640
4-hydroxy-N-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]benzamide
CID 6906205
(E)-4-bromo-N'-(2-hydroxybenzylidene)benzohydrazide
CID 135412162
Mls002667267
CID 241689
4-Methylbenzoic (2-hydroxy-1-naphthylmethylene)hydrazide
CID 135407190

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide?
The IUPAC name of N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide (CID 135459102) is N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide.
What is the SMILES notation for N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide?
The canonical SMILES for N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide is Cc1ccc(C(=O)N/N=C/c2ccccc2O)cc1.
What is the InChIKey of N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide?
The InChIKey is DPUVCYHYDOCXKP-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-11-6-8-12(9-7-11)15(19)17-16-10-13-4-2-3-5-14(13)18/h2-10,18H,1H3,(H,17,19)/b16-10+.
What are the key properties of N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide?
N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide has a molecular weight of 254.29 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-methylbenzamide is sourced from PubChem (CID 135459102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).