2-methoxy-6-(3-nitrophenyl)pyridine

C12H10N2O3 — CID 53328277

IUPAC2-methoxy-6-(3-nitrophenyl)pyridine
SMILESCOc1cccc(-c2cccc([N+](=O)[O-])c2)n1
InChIInChI=1S/C12H10N2O3/c1-17-12-7-3-6-11(13-12)9-4-2-5-10(8-9)14(15)16/h2-8H,1H3
InChIKeyZWRIZAWLCBNRDU-UHFFFAOYSA-N
MW230.22 g/mol
LogP2.67
Rot. Bonds3

About 2-methoxy-6-(3-nitrophenyl)pyridine

2-methoxy-6-(3-nitrophenyl)pyridine (PubChem CID 53328277) has the molecular formula C12H10N2O3 and a molecular weight of 230.22 g/mol. Its IUPAC name is 2-methoxy-6-(3-nitrophenyl)pyridine.

Molecular Properties

Compound Name2-methoxy-6-(3-nitrophenyl)pyridine
PubChem CID53328277
Molecular FormulaC12H10N2O3
Molecular Weight230.22 g/mol
Exact Mass230.07
IUPAC Name2-methoxy-6-(3-nitrophenyl)pyridine
SMILESCOc1cccc(-c2cccc([N+](=O)[O-])c2)n1
InChIInChI=1S/C12H10N2O3/c1-17-12-7-3-6-11(13-12)9-4-2-5-10(8-9)14(15)16/h2-8H,1H3
InChIKeyZWRIZAWLCBNRDU-UHFFFAOYSA-N
XLogP2.67
TPSA65.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.22
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', '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-methoxy-6-(3-nitrophenyl)pyridine?
The IUPAC name of 2-methoxy-6-(3-nitrophenyl)pyridine (CID 53328277) is 2-methoxy-6-(3-nitrophenyl)pyridine.
What is the SMILES notation for 2-methoxy-6-(3-nitrophenyl)pyridine?
The canonical SMILES for 2-methoxy-6-(3-nitrophenyl)pyridine is COc1cccc(-c2cccc([N+](=O)[O-])c2)n1.
What is the InChIKey of 2-methoxy-6-(3-nitrophenyl)pyridine?
The InChIKey is ZWRIZAWLCBNRDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O3/c1-17-12-7-3-6-11(13-12)9-4-2-5-10(8-9)14(15)16/h2-8H,1H3.
What are the key properties of 2-methoxy-6-(3-nitrophenyl)pyridine?
2-methoxy-6-(3-nitrophenyl)pyridine has a molecular weight of 230.22 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(3-nitrophenyl)pyridine is sourced from PubChem (CID 53328277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).