(2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide

C8H6Cl2N2O2 — CID 6409669

IUPAC(2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide
SMILESO=C(/C=N\O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C8H6Cl2N2O2/c9-5-1-2-6(10)7(3-5)12-8(13)4-11-14/h1-4,14H,(H,12,13)/b11-4-
InChIKeyQHQMDDDKRFDIOT-WCIBSUBMSA-N
MW233.05 g/mol
LogP2.39
Rot. Bonds2

About (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide

(2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide (PubChem CID 6409669) has the molecular formula C8H6Cl2N2O2 and a molecular weight of 233.05 g/mol. Its IUPAC name is (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide.

Molecular Properties

Compound Name(2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide
PubChem CID6409669
Molecular FormulaC8H6Cl2N2O2
Molecular Weight233.05 g/mol
Exact Mass231.98
IUPAC Name(2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide
SMILESO=C(/C=N\O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C8H6Cl2N2O2/c9-5-1-2-6(10)7(3-5)12-8(13)4-11-14/h1-4,14H,(H,12,13)/b11-4-
InChIKeyQHQMDDDKRFDIOT-WCIBSUBMSA-N
XLogP2.39
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.05
LogP ≤ 52.39
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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Related Compounds

3-(4-chlorophenyl)-N-(2,5-dichlorophenyl)prop-2-enamide
CID 3324390
N-(2,5-difluorophenyl)-2-hydroxyiminoacetamide
CID 86044839
(E)-4-(2,5-dichloroanilino)-2-methyl-4-oxobut-2-enoic acid
CID 82335576
(2E)-2-amino-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide
CID 53274928
(2E)-N-(4-chloro-2-fluoro-3-methoxyphenyl)-2-hydroxyiminoacetamide
CID 170552143
1-(carbamoylamino)-3-(2,5-dichlorophenyl)urea
CID 75369271
1-N,1-N'-bis(2,5-dichlorophenyl)cyclopropane-1,1-dicarboxamide
CID 155683538
(2Z)-N-(2,5-dimethylphenyl)-2-hydroxyiminoacetamide
CID 6418397
methyl 2-(2,5-dichloroanilino)-2-oxoacetate
CID 11543309
N-(2,5-dichlorophenyl)-3-hydroxypropanamide
CID 43558723
1-(2,5-dichlorophenyl)-3-[(E)-prop-1-enyl]urea
CID 108909411
5-(2,5-dichloroanilino)-5-oxopentanoic acid
CID 3516353

Frequently Asked Questions

What is the IUPAC name of (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide?
The IUPAC name of (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide (CID 6409669) is (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide.
What is the SMILES notation for (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide?
The canonical SMILES for (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide is O=C(/C=N\O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide?
The InChIKey is QHQMDDDKRFDIOT-WCIBSUBMSA-N. The full InChI is InChI=1S/C8H6Cl2N2O2/c9-5-1-2-6(10)7(3-5)12-8(13)4-11-14/h1-4,14H,(H,12,13)/b11-4-.
What are the key properties of (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide?
(2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide has a molecular weight of 233.05 g/mol, XLogP of 2.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-(2,5-dichlorophenyl)-2-hydroxyiminoacetamide is sourced from PubChem (CID 6409669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).