2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide

C7H9BrN4O — CID 139977607

IUPAC2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide
SMILESNNc1cccc(NC(=O)CBr)n1
InChIInChI=1S/C7H9BrN4O/c8-4-7(13)11-5-2-1-3-6(10-5)12-9/h1-3H,4,9H2,(H2,10,11,12,13)
InChIKeyZPNMOASHOGWLRU-UHFFFAOYSA-N
MW245.08 g/mol
LogP0.70
Rot. Bonds3

About 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide

2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide (PubChem CID 139977607) has the molecular formula C7H9BrN4O and a molecular weight of 245.08 g/mol. Its IUPAC name is 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide
PubChem CID139977607
Molecular FormulaC7H9BrN4O
Molecular Weight245.08 g/mol
Exact Mass244.00
IUPAC Name2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide
SMILESNNc1cccc(NC(=O)CBr)n1
InChIInChI=1S/C7H9BrN4O/c8-4-7(13)11-5-2-1-3-6(10-5)12-9/h1-3H,4,9H2,(H2,10,11,12,13)
InChIKeyZPNMOASHOGWLRU-UHFFFAOYSA-N
XLogP0.70
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.08
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'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 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide?
The IUPAC name of 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide (CID 139977607) is 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide is NNc1cccc(NC(=O)CBr)n1.
What is the InChIKey of 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide?
The InChIKey is ZPNMOASHOGWLRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN4O/c8-4-7(13)11-5-2-1-3-6(10-5)12-9/h1-3H,4,9H2,(H2,10,11,12,13).
What are the key properties of 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide?
2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide has a molecular weight of 245.08 g/mol, XLogP of 0.70, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(6-hydrazinyl-2-pyridinyl)acetamide is sourced from PubChem (CID 139977607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).