N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide

C12H10Br2N4O — CID 62247489

IUPACN-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ccc(C(=O)Nc2cc(Br)ccc2Br)cn1
InChIInChI=1S/C12H10Br2N4O/c13-8-2-3-9(14)10(5-8)17-12(19)7-1-4-11(18-15)16-6-7/h1-6H,15H2,(H,16,18)(H,17,19)
InChIKeyLQRKEQCEUQVDTI-UHFFFAOYSA-N
MW386.05 g/mol
LogP3.14
Rot. Bonds3

About N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide

N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide (PubChem CID 62247489) has the molecular formula C12H10Br2N4O and a molecular weight of 386.05 g/mol. Its IUPAC name is N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
PubChem CID62247489
Molecular FormulaC12H10Br2N4O
Molecular Weight386.05 g/mol
Exact Mass383.92
IUPAC NameN-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ccc(C(=O)Nc2cc(Br)ccc2Br)cn1
InChIInChI=1S/C12H10Br2N4O/c13-8-2-3-9(14)10(5-8)17-12(19)7-1-4-11(18-15)16-6-7/h1-6H,15H2,(H,16,18)(H,17,19)
InChIKeyLQRKEQCEUQVDTI-UHFFFAOYSA-N
XLogP3.14
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.05
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The IUPAC name of N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide (CID 62247489) is N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide is NNc1ccc(C(=O)Nc2cc(Br)ccc2Br)cn1.
What is the InChIKey of N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The InChIKey is LQRKEQCEUQVDTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Br2N4O/c13-8-2-3-9(14)10(5-8)17-12(19)7-1-4-11(18-15)16-6-7/h1-6H,15H2,(H,16,18)(H,17,19).
What are the key properties of N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide?
N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide has a molecular weight of 386.05 g/mol, XLogP of 3.14, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 62247489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).