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

C10H12N2O2 — CID 135723720

IUPACN-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide
SMILESCC(=O)N/N=C/c1cc(C)ccc1O
InChIInChI=1S/C10H12N2O2/c1-7-3-4-10(14)9(5-7)6-11-12-8(2)13/h3-6,14H,1-2H3,(H,12,13)/b11-6+
InChIKeyDEOGFUDGDRCELI-IZZDOVSWSA-N
MW192.22 g/mol
LogP1.17
Rot. Bonds2

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

N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide (PubChem CID 135723720) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide.

Molecular Properties

Compound NameN-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide
PubChem CID135723720
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC NameN-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide
SMILESCC(=O)N/N=C/c1cc(C)ccc1O
InChIInChI=1S/C10H12N2O2/c1-7-3-4-10(14)9(5-7)6-11-12-8(2)13/h3-6,14H,1-2H3,(H,12,13)/b11-6+
InChIKeyDEOGFUDGDRCELI-IZZDOVSWSA-N
XLogP1.17
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 ≤ 51.17
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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Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide?
The IUPAC name of N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide (CID 135723720) is N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide.
What is the SMILES notation for N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide?
The canonical SMILES for N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide is CC(=O)N/N=C/c1cc(C)ccc1O.
What is the InChIKey of N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide?
The InChIKey is DEOGFUDGDRCELI-IZZDOVSWSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-7-3-4-10(14)9(5-7)6-11-12-8(2)13/h3-6,14H,1-2H3,(H,12,13)/b11-6+.
What are the key properties of N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide?
N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]acetamide has a molecular weight of 192.22 g/mol, XLogP of 1.17, 2 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]acetamide is sourced from PubChem (CID 135723720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).