5-(2-azidoethenyl)-2,3-dichloropyridine

C7H4Cl2N4 — CID 123496215

IUPAC5-(2-azidoethenyl)-2,3-dichloropyridine
SMILES[N-]=[N+]=NC=Cc1cnc(Cl)c(Cl)c1
InChIInChI=1S/C7H4Cl2N4/c8-6-3-5(1-2-12-13-10)4-11-7(6)9/h1-4H
InChIKeyFYGZMQNGHIHXRA-UHFFFAOYSA-N
MW215.04 g/mol
LogP3.67
Rot. Bonds2

About 5-(2-azidoethenyl)-2,3-dichloropyridine

5-(2-azidoethenyl)-2,3-dichloropyridine (PubChem CID 123496215) has the molecular formula C7H4Cl2N4 and a molecular weight of 215.04 g/mol. Its IUPAC name is 5-(2-azidoethenyl)-2,3-dichloropyridine.

Molecular Properties

Compound Name5-(2-azidoethenyl)-2,3-dichloropyridine
PubChem CID123496215
Molecular FormulaC7H4Cl2N4
Molecular Weight215.04 g/mol
Exact Mass213.98
IUPAC Name5-(2-azidoethenyl)-2,3-dichloropyridine
SMILES[N-]=[N+]=NC=Cc1cnc(Cl)c(Cl)c1
InChIInChI=1S/C7H4Cl2N4/c8-6-3-5(1-2-12-13-10)4-11-7(6)9/h1-4H
InChIKeyFYGZMQNGHIHXRA-UHFFFAOYSA-N
XLogP3.67
TPSA61.65 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.04
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(2-azidoethenyl)-2,3-dichloropyridine?
The IUPAC name of 5-(2-azidoethenyl)-2,3-dichloropyridine (CID 123496215) is 5-(2-azidoethenyl)-2,3-dichloropyridine.
What is the SMILES notation for 5-(2-azidoethenyl)-2,3-dichloropyridine?
The canonical SMILES for 5-(2-azidoethenyl)-2,3-dichloropyridine is [N-]=[N+]=NC=Cc1cnc(Cl)c(Cl)c1.
What is the InChIKey of 5-(2-azidoethenyl)-2,3-dichloropyridine?
The InChIKey is FYGZMQNGHIHXRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Cl2N4/c8-6-3-5(1-2-12-13-10)4-11-7(6)9/h1-4H.
What are the key properties of 5-(2-azidoethenyl)-2,3-dichloropyridine?
5-(2-azidoethenyl)-2,3-dichloropyridine has a molecular weight of 215.04 g/mol, XLogP of 3.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-azidoethenyl)-2,3-dichloropyridine is sourced from PubChem (CID 123496215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).