2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide

C8H8ClN3O2 — CID 6846906

IUPAC2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide
SMILESNC(=NO)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C8H8ClN3O2/c9-5-1-3-6(4-2-5)11-8(13)7(10)12-14/h1-4,14H,(H2,10,12)(H,11,13)
InChIKeyXMHQCUUITZGTSB-UHFFFAOYSA-N
MW213.62 g/mol
LogP1.02
Rot. Bonds1

About 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide

2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide (PubChem CID 6846906) has the molecular formula C8H8ClN3O2 and a molecular weight of 213.62 g/mol. Its IUPAC name is 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide.

Molecular Properties

Compound Name2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide
PubChem CID6846906
Molecular FormulaC8H8ClN3O2
Molecular Weight213.62 g/mol
Exact Mass213.03
IUPAC Name2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide
SMILESNC(=NO)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C8H8ClN3O2/c9-5-1-3-6(4-2-5)11-8(13)7(10)12-14/h1-4,14H,(H2,10,12)(H,11,13)
InChIKeyXMHQCUUITZGTSB-UHFFFAOYSA-N
XLogP1.02
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.62
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide?
The IUPAC name of 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide (CID 6846906) is 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide.
What is the SMILES notation for 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide?
The canonical SMILES for 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide is NC(=NO)C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide?
The InChIKey is XMHQCUUITZGTSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3O2/c9-5-1-3-6(4-2-5)11-8(13)7(10)12-14/h1-4,14H,(H2,10,12)(H,11,13).
What are the key properties of 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide?
2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide has a molecular weight of 213.62 g/mol, XLogP of 1.02, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-chlorophenyl)-2-hydroxyiminoacetamide is sourced from PubChem (CID 6846906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).