N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide

C8H7BrClN3O2 — CID 107615247

IUPACN-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide
SMILESNNC(=O)C(=O)Nc1ccc(Br)c(Cl)c1
InChIInChI=1S/C8H7BrClN3O2/c9-5-2-1-4(3-6(5)10)12-7(14)8(15)13-11/h1-3H,11H2,(H,12,14)(H,13,15)
InChIKeyYKRNNGWVICMBOI-UHFFFAOYSA-N
MW292.52 g/mol
LogP1.03
Rot. Bonds1

About N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide

N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide (PubChem CID 107615247) has the molecular formula C8H7BrClN3O2 and a molecular weight of 292.52 g/mol. Its IUPAC name is N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide.

Molecular Properties

Compound NameN-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide
PubChem CID107615247
Molecular FormulaC8H7BrClN3O2
Molecular Weight292.52 g/mol
Exact Mass290.94
IUPAC NameN-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide
SMILESNNC(=O)C(=O)Nc1ccc(Br)c(Cl)c1
InChIInChI=1S/C8H7BrClN3O2/c9-5-2-1-4(3-6(5)10)12-7(14)8(15)13-11/h1-3H,11H2,(H,12,14)(H,13,15)
InChIKeyYKRNNGWVICMBOI-UHFFFAOYSA-N
XLogP1.03
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.52
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(4-chloro-3-methoxyphenyl)-2-hydrazinyl-2-oxoacetamide
CID 107622734
N-(4-bromo-3-chlorophenyl)-2-oxo-2-piperazin-1-ylacetamide
CID 107614812
N-[4-[(4-bromo-3-chlorophenyl)carbamothioylamino]phenyl]acetamide
CID 15954823
N-(4-bromo-3-chlorophenyl)-4-sulfanylbenzamide
CID 107617517
ethyl 3-(4-bromo-3-chloroanilino)-3-oxopropanoate
CID 134123354
N-(3,5-dichlorophenyl)-2-hydrazinyl-2-oxoacetamide
CID 4862754
2,4-dibromo-N-(4-bromo-3-chlorophenyl)benzamide
CID 114018393
N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide
CID 108516155
N-(4-bromo-3-chlorophenyl)-5-chloro-2-fluorobenzamide
CID 107619744
1-(3-amino-4-bromophenyl)-3-(3,4-dichlorophenyl)urea
CID 79767592
3-amino-N-(4-bromo-3-chlorophenyl)-2-hydroxybenzamide
CID 107618385
2-[(4-bromo-3-chlorophenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 107618657

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide?
The IUPAC name of N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide (CID 107615247) is N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide.
What is the SMILES notation for N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide?
The canonical SMILES for N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide is NNC(=O)C(=O)Nc1ccc(Br)c(Cl)c1.
What is the InChIKey of N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide?
The InChIKey is YKRNNGWVICMBOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7BrClN3O2/c9-5-2-1-4(3-6(5)10)12-7(14)8(15)13-11/h1-3H,11H2,(H,12,14)(H,13,15).
What are the key properties of N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide?
N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide has a molecular weight of 292.52 g/mol, XLogP of 1.03, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-chlorophenyl)-2-hydrazinyl-2-oxoacetamide is sourced from PubChem (CID 107615247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).