2-[(3,5-dichlorophenyl)methylamino]oxyacetamide

C9H10Cl2N2O2 — CID 112672702

IUPAC2-[(3,5-dichlorophenyl)methylamino]oxyacetamide
SMILESNC(=O)CONCc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C9H10Cl2N2O2/c10-7-1-6(2-8(11)3-7)4-13-15-5-9(12)14/h1-3,13H,4-5H2,(H2,12,14)
InChIKeyBYNOSHRUMXVCDQ-UHFFFAOYSA-N
MW249.10 g/mol
LogP1.50
Rot. Bonds5

About 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide

2-[(3,5-dichlorophenyl)methylamino]oxyacetamide (PubChem CID 112672702) has the molecular formula C9H10Cl2N2O2 and a molecular weight of 249.10 g/mol. Its IUPAC name is 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide.

Molecular Properties

Compound Name2-[(3,5-dichlorophenyl)methylamino]oxyacetamide
PubChem CID112672702
Molecular FormulaC9H10Cl2N2O2
Molecular Weight249.10 g/mol
Exact Mass248.01
IUPAC Name2-[(3,5-dichlorophenyl)methylamino]oxyacetamide
SMILESNC(=O)CONCc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C9H10Cl2N2O2/c10-7-1-6(2-8(11)3-7)4-13-15-5-9(12)14/h1-3,13H,4-5H2,(H2,12,14)
InChIKeyBYNOSHRUMXVCDQ-UHFFFAOYSA-N
XLogP1.50
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.10
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide with MolForge

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

Launch Full Analysis

Related Compounds

2-[2-[(3,5-dichlorophenyl)methylamino]ethoxy]acetamide
CID 114162125
2-[(3,4-dichlorophenyl)methylamino]oxyacetamide
CID 112672874
2-[(3-bromo-4-chlorophenyl)methylamino]oxyacetamide
CID 112672866
2-(pyrimidin-5-ylmethylamino)oxyacetamide
CID 112672662
2-[(2-bromo-4-chlorophenyl)methylamino]oxyacetamide
CID 112672620
2-[(4-phenylphenyl)methylamino]oxyacetamide
CID 112673244
2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide
CID 60790039
2-[(3-bromo-4-methoxyphenyl)methylamino]oxyacetamide
CID 112672945
2-[(4-ethoxyphenyl)methylamino]oxyacetamide
CID 112673119
2-[[4-(trifluoromethoxy)phenyl]methylamino]oxyacetamide
CID 112673035
(3,5-dichlorophenyl)methylthiourea;hydrochloride
CID 23079401
N-(2-amino-2-oxoethoxy)-5-chloro-2-fluorobenzamide
CID 112551004

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide?
The IUPAC name of 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide (CID 112672702) is 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide.
What is the SMILES notation for 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide?
The canonical SMILES for 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide is NC(=O)CONCc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide?
The InChIKey is BYNOSHRUMXVCDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2N2O2/c10-7-1-6(2-8(11)3-7)4-13-15-5-9(12)14/h1-3,13H,4-5H2,(H2,12,14).
What are the key properties of 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide?
2-[(3,5-dichlorophenyl)methylamino]oxyacetamide has a molecular weight of 249.10 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dichlorophenyl)methylamino]oxyacetamide is sourced from PubChem (CID 112672702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).