5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide

C13H10Br2ClN3O — CID 62247491

IUPAC5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide
SMILESNNc1ccc(Cl)cc1C(=O)Nc1cc(Br)ccc1Br
InChIInChI=1S/C13H10Br2ClN3O/c14-7-1-3-10(15)12(5-7)18-13(20)9-6-8(16)2-4-11(9)19-17/h1-6,19H,17H2,(H,18,20)
InChIKeyBCKWWHXKFRBRAS-UHFFFAOYSA-N
MW419.50 g/mol
LogP4.40
Rot. Bonds3

About 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide

5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide (PubChem CID 62247491) has the molecular formula C13H10Br2ClN3O and a molecular weight of 419.50 g/mol. Its IUPAC name is 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide.

Molecular Properties

Compound Name5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide
PubChem CID62247491
Molecular FormulaC13H10Br2ClN3O
Molecular Weight419.50 g/mol
Exact Mass416.89
IUPAC Name5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide
SMILESNNc1ccc(Cl)cc1C(=O)Nc1cc(Br)ccc1Br
InChIInChI=1S/C13H10Br2ClN3O/c14-7-1-3-10(15)12(5-7)18-13(20)9-6-8(16)2-4-11(9)19-17/h1-6,19H,17H2,(H,18,20)
InChIKeyBCKWWHXKFRBRAS-UHFFFAOYSA-N
XLogP4.40
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.50
LogP ≤ 54.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2,4-dibromo-N-(2-bromo-5-chlorophenyl)benzamide
CID 114018389
4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide
CID 81271772
5-chloro-N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzamide
CID 62242667
2,5-dibromo-N-(4-chloro-2-fluorophenyl)benzamide
CID 114370697
N-(5-bromo-2-fluorophenyl)-2-hydrazinyl-5-methylbenzamide
CID 62513483
2-amino-4-chloro-N-(2,4-dibromophenyl)benzamide
CID 61471749
2-amino-4-bromo-N-(2-bromo-4-chlorophenyl)benzamide
CID 81263873
N-(2-amino-5-chlorophenyl)-2,5-dibromobenzamide
CID 114367618
N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81272267
2-chloro-N-(2,5-dibromophenyl)-5-hydroxybenzamide
CID 106501529
2-amino-N-(2-bromo-5-chlorophenyl)benzamide
CID 81263172
5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide
CID 107606119

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide?
The IUPAC name of 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide (CID 62247491) is 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide.
What is the SMILES notation for 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide?
The canonical SMILES for 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide is NNc1ccc(Cl)cc1C(=O)Nc1cc(Br)ccc1Br.
What is the InChIKey of 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide?
The InChIKey is BCKWWHXKFRBRAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Br2ClN3O/c14-7-1-3-10(15)12(5-7)18-13(20)9-6-8(16)2-4-11(9)19-17/h1-6,19H,17H2,(H,18,20).
What are the key properties of 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide?
5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide has a molecular weight of 419.50 g/mol, XLogP of 4.40, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide is sourced from PubChem (CID 62247491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).