(2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide

C9H10N2O2 — CID 6871299

IUPAC(2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)/C=N/O
InChIInChI=1S/C9H10N2O2/c1-7-4-2-3-5-8(7)11-9(12)6-10-13/h2-6,13H,1H3,(H,11,12)/b10-6+
InChIKeyXLFBDBCQQNVKHU-UXBLZVDNSA-N
MW178.19 g/mol
LogP1.39
Rot. Bonds2

About (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide

(2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide (PubChem CID 6871299) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name(2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide
PubChem CID6871299
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Name(2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)/C=N/O
InChIInChI=1S/C9H10N2O2/c1-7-4-2-3-5-8(7)11-9(12)6-10-13/h2-6,13H,1H3,(H,11,12)/b10-6+
InChIKeyXLFBDBCQQNVKHU-UXBLZVDNSA-N
XLogP1.39
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_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 (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide?
The IUPAC name of (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide (CID 6871299) is (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide.
What is the SMILES notation for (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide?
The canonical SMILES for (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)/C=N/O.
What is the InChIKey of (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide?
The InChIKey is XLFBDBCQQNVKHU-UXBLZVDNSA-N. The full InChI is InChI=1S/C9H10N2O2/c1-7-4-2-3-5-8(7)11-9(12)6-10-13/h2-6,13H,1H3,(H,11,12)/b10-6+.
What are the key properties of (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide?
(2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide has a molecular weight of 178.19 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 6871299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).