5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide

C13H10Cl2IN3O — CID 107606119

IUPAC5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide
SMILESNNc1ccc(Cl)cc1C(=O)Nc1ccc(I)cc1Cl
InChIInChI=1S/C13H10Cl2IN3O/c14-7-1-3-11(19-17)9(5-7)13(20)18-12-4-2-8(16)6-10(12)15/h1-6,19H,17H2,(H,18,20)
InChIKeyDNRRQLIAXGKSDI-UHFFFAOYSA-N
MW422.05 g/mol
LogP4.14
Rot. Bonds3

About 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide

5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide (PubChem CID 107606119) has the molecular formula C13H10Cl2IN3O and a molecular weight of 422.05 g/mol. Its IUPAC name is 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide.

Molecular Properties

Compound Name5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide
PubChem CID107606119
Molecular FormulaC13H10Cl2IN3O
Molecular Weight422.05 g/mol
Exact Mass420.92
IUPAC Name5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide
SMILESNNc1ccc(Cl)cc1C(=O)Nc1ccc(I)cc1Cl
InChIInChI=1S/C13H10Cl2IN3O/c14-7-1-3-11(19-17)9(5-7)13(20)18-12-4-2-8(16)6-10(12)15/h1-6,19H,17H2,(H,18,20)
InChIKeyDNRRQLIAXGKSDI-UHFFFAOYSA-N
XLogP4.14
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.05
LogP ≤ 54.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-4-chloro-N-(2-chloro-4-iodophenyl)benzamide
CID 114024506
5-chloro-N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzamide
CID 62242667
N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide
CID 107606116
1-amino-3-(2-chloro-4-iodophenyl)urea
CID 107605938
N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 107606112
5-chloro-N-(3-chlorophenyl)-2-hydrazinylbenzamide
CID 55052324
5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide
CID 62247491
N-(2-chloro-4-iodophenyl)acetamide
CID 18434368
N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide
CID 5150334
5-chloro-2-hydrazinyl-N-(3,4,5-trifluorophenyl)benzamide
CID 62812110
5-chloro-N-(5-chloro-2-pyridinyl)-2-hydrazinylbenzamide
CID 55051225
5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide
CID 62241246

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide?
The IUPAC name of 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide (CID 107606119) is 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide.
What is the SMILES notation for 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide?
The canonical SMILES for 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide is NNc1ccc(Cl)cc1C(=O)Nc1ccc(I)cc1Cl.
What is the InChIKey of 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide?
The InChIKey is DNRRQLIAXGKSDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2IN3O/c14-7-1-3-11(19-17)9(5-7)13(20)18-12-4-2-8(16)6-10(12)15/h1-6,19H,17H2,(H,18,20).
What are the key properties of 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide?
5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide has a molecular weight of 422.05 g/mol, XLogP of 4.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide is sourced from PubChem (CID 107606119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).