2,6-dichloro-4-nitropyridine

C5H2Cl2N2O2 — CID 3841070

IUPAC2,6-dichloro-4-nitropyridine
SMILESO=[N+]([O-])c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C5H2Cl2N2O2/c6-4-1-3(9(10)11)2-5(7)8-4/h1-2H
InChIKeyBZYQSSVTQJTUDD-UHFFFAOYSA-N
MW192.99 g/mol
LogP2.30
Rot. Bonds1

About 2,6-dichloro-4-nitropyridine

2,6-dichloro-4-nitropyridine (PubChem CID 3841070) has the molecular formula C5H2Cl2N2O2 and a molecular weight of 192.99 g/mol. Its IUPAC name is 2,6-dichloro-4-nitropyridine.

Molecular Properties

Compound Name2,6-dichloro-4-nitropyridine
PubChem CID3841070
Molecular FormulaC5H2Cl2N2O2
Molecular Weight192.99 g/mol
Exact Mass191.95
IUPAC Name2,6-dichloro-4-nitropyridine
SMILESO=[N+]([O-])c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C5H2Cl2N2O2/c6-4-1-3(9(10)11)2-5(7)8-4/h1-2H
InChIKeyBZYQSSVTQJTUDD-UHFFFAOYSA-N
XLogP2.30
TPSA56.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.99
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-Chloro-4-nitropyridine 1-oxide
CID 84433
2,6-Dichloropyridine N-Oxide
CID 817673
2,6-Lutidine, 4-nitro-, 1-oxide
CID 20945
2,6-Dichloro-4-nitropyridine-N-oxide
CID 2784721
2,6-Dichloro-3-nitropyridine
CID 85239
4-Amino-2,6-dichloropyridine
CID 137652
2-Chloro-4-nitropyridine
CID 735152
2-Chloro-6-methyl-3-nitropyridine
CID 1268230
2,4-Dichloro-6-methyl-3-nitropyridine
CID 2784819
2-Chloro-5-methyl-4-nitropyridine N-oxide
CID 12318010
2,6-Dichloro-3-nitropyridin-4-amine
CID 282740
2-Chloro-6-methyl-4-nitropyridine
CID 298607

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-4-nitropyridine?
The IUPAC name of 2,6-dichloro-4-nitropyridine (CID 3841070) is 2,6-dichloro-4-nitropyridine.
What is the SMILES notation for 2,6-dichloro-4-nitropyridine?
The canonical SMILES for 2,6-dichloro-4-nitropyridine is O=[N+]([O-])c1cc(Cl)nc(Cl)c1.
What is the InChIKey of 2,6-dichloro-4-nitropyridine?
The InChIKey is BZYQSSVTQJTUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2Cl2N2O2/c6-4-1-3(9(10)11)2-5(7)8-4/h1-2H.
What are the key properties of 2,6-dichloro-4-nitropyridine?
2,6-dichloro-4-nitropyridine has a molecular weight of 192.99 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-4-nitropyridine is sourced from PubChem (CID 3841070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).