N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide

C16H16N2O2 — CID 135458739

IUPACN-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide
SMILESCc1ccc(O)c(/C=N/NC(=O)Cc2ccccc2)c1
InChIInChI=1S/C16H16N2O2/c1-12-7-8-15(19)14(9-12)11-17-18-16(20)10-13-5-3-2-4-6-13/h2-9,11,19H,10H2,1H3,(H,18,20)/b17-11+
InChIKeyXSVFRXVJOIXMRP-GZTJUZNOSA-N
MW268.32 g/mol
LogP2.39
Rot. Bonds4

About N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide

N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide (PubChem CID 135458739) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide.

Molecular Properties

Compound NameN-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide
PubChem CID135458739
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide
SMILESCc1ccc(O)c(/C=N/NC(=O)Cc2ccccc2)c1
InChIInChI=1S/C16H16N2O2/c1-12-7-8-15(19)14(9-12)11-17-18-16(20)10-13-5-3-2-4-6-13/h2-9,11,19H,10H2,1H3,(H,18,20)/b17-11+
InChIKeyXSVFRXVJOIXMRP-GZTJUZNOSA-N
XLogP2.39
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.39
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

4-Hydroxybenzoic (2-hydroxybenzylidene)hydrazide
CID 135778696
Gsk 4716
CID 5331325
Nsc204792
CID 135459102
N'-(3-hydroxybenzylidene)-3-phenylpropanohydrazide
CID 5337816
Mls002667267
CID 241689
Salicylic (4-hydroxybenzylidene)hydrazide
CID 135504499
(E)-N'-(4-hydroxybenzylidene)benzohydrazide
CID 135459360
2-hydroxy-N-[(2-hydroxyphenyl)methylideneamino]-2,2-diphenylacetamide
CID 267472
(4-Chloro-phenyl)-acetic acid (2-hydroxy-5-methyl-benzylidene)-hydrazide
CID 135531708
(4-Chloro-phenyl)-acetic acid (2-hydroxy-3-methyl-benzylidene)-hydrazide
CID 135531710
N'-[(1E)-1-(4-hydroxyphenyl)ethylidene]-2,2-diphenylacetohydrazide
CID 135603353
N'-[(E)-(2-hydroxyphenyl)methylidene]cyclopentanecarbohydrazide
CID 135647875

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide?
The IUPAC name of N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide (CID 135458739) is N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide.
What is the SMILES notation for N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide?
The canonical SMILES for N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide is Cc1ccc(O)c(/C=N/NC(=O)Cc2ccccc2)c1.
What is the InChIKey of N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide?
The InChIKey is XSVFRXVJOIXMRP-GZTJUZNOSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-12-7-8-15(19)14(9-12)11-17-18-16(20)10-13-5-3-2-4-6-13/h2-9,11,19H,10H2,1H3,(H,18,20)/b17-11+.
What are the key properties of N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide?
N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide has a molecular weight of 268.32 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]-2-phenylacetamide is sourced from PubChem (CID 135458739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).