2-azido-4-methoxypyridine

C6H6N4O — CID 102249989

IUPAC2-azido-4-methoxypyridine
SMILESCOc1ccnc(N=[N+]=[N-])c1
InChIInChI=1S/C6H6N4O/c1-11-5-2-3-8-6(4-5)9-10-7/h2-4H,1H3
InChIKeySCGQRENCFXCZSM-UHFFFAOYSA-N
MW150.14 g/mol
LogP2.03
Rot. Bonds2

About 2-azido-4-methoxypyridine

2-azido-4-methoxypyridine (PubChem CID 102249989) has the molecular formula C6H6N4O and a molecular weight of 150.14 g/mol. Its IUPAC name is 2-azido-4-methoxypyridine.

Molecular Properties

Compound Name2-azido-4-methoxypyridine
PubChem CID102249989
Molecular FormulaC6H6N4O
Molecular Weight150.14 g/mol
Exact Mass150.05
IUPAC Name2-azido-4-methoxypyridine
SMILESCOc1ccnc(N=[N+]=[N-])c1
InChIInChI=1S/C6H6N4O/c1-11-5-2-3-8-6(4-5)9-10-7/h2-4H,1H3
InChIKeySCGQRENCFXCZSM-UHFFFAOYSA-N
XLogP2.03
TPSA70.88 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', '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 2-azido-4-methoxypyridine?
The IUPAC name of 2-azido-4-methoxypyridine (CID 102249989) is 2-azido-4-methoxypyridine.
What is the SMILES notation for 2-azido-4-methoxypyridine?
The canonical SMILES for 2-azido-4-methoxypyridine is COc1ccnc(N=[N+]=[N-])c1.
What is the InChIKey of 2-azido-4-methoxypyridine?
The InChIKey is SCGQRENCFXCZSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4O/c1-11-5-2-3-8-6(4-5)9-10-7/h2-4H,1H3.
What are the key properties of 2-azido-4-methoxypyridine?
2-azido-4-methoxypyridine has a molecular weight of 150.14 g/mol, XLogP of 2.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azido-4-methoxypyridine is sourced from PubChem (CID 102249989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).