N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide

C10H12N2O2 — CID 20646050

IUPACN-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide
SMILESC/C=N/NC(=O)c1cccc(C)c1O
InChIInChI=1S/C10H12N2O2/c1-3-11-12-10(14)8-6-4-5-7(2)9(8)13/h3-6,13H,1-2H3,(H,12,14)/b11-3+
InChIKeyFVLHYDGHXRXSSD-QDEBKDIKSA-N
MW192.22 g/mol
LogP1.44
Rot. Bonds2

About N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide

N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide (PubChem CID 20646050) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide.

Molecular Properties

Compound NameN-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide
PubChem CID20646050
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC NameN-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide
SMILESC/C=N/NC(=O)c1cccc(C)c1O
InChIInChI=1S/C10H12N2O2/c1-3-11-12-10(14)8-6-4-5-7(2)9(8)13/h3-6,13H,1-2H3,(H,12,14)/b11-3+
InChIKeyFVLHYDGHXRXSSD-QDEBKDIKSA-N
XLogP1.44
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(5-bromo-2-hydroxyphenyl)methylideneamino]-2-hydroxy-3-methylbenzamide
CID 137203260
N-[(E)-(3-ethoxy-2-hydroxyphenyl)methylideneamino]-2-hydroxy-3-methylbenzamide
CID 139083037
2-amino-N-(ethylideneamino)benzamide
CID 171131868
N-(2,2-dichloroethenyl)-2-hydroxy-3-methylbenzamide
CID 12837651
N-[(E)-1-(4-aminophenyl)ethylideneamino]-2-hydroxy-3-methylbenzamide
CID 17337861
hydrogen peroxide;2-hydroxy-3-methylbenzoic acid
CID 161037568
2-hydroxy-N-[(Z)-(2-methylphenyl)methylideneamino]benzamide
CID 5392167
2-chloro-N-[(Z)-(2,6-dimethylphenyl)methylideneamino]benzamide
CID 7416956
N-[4-(cyanomethyl)phenyl]-2-hydroxy-3-methylbenzamide
CID 60682495
N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide
CID 43405605
2-methyl-N-(2-methylpropylideneamino)benzamide
CID 4623987
2-[(2-hydroxy-3-methylbenzoyl)amino]propanoic acid
CID 24709135

Frequently Asked Questions

What is the IUPAC name of N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide?
The IUPAC name of N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide (CID 20646050) is N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide.
What is the SMILES notation for N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide?
The canonical SMILES for N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide is C/C=N/NC(=O)c1cccc(C)c1O.
What is the InChIKey of N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide?
The InChIKey is FVLHYDGHXRXSSD-QDEBKDIKSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-3-11-12-10(14)8-6-4-5-7(2)9(8)13/h3-6,13H,1-2H3,(H,12,14)/b11-3+.
What are the key properties of N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide?
N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide has a molecular weight of 192.22 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-ethylideneamino]-2-hydroxy-3-methylbenzamide is sourced from PubChem (CID 20646050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).