3-azido-6-methoxy-2-methylpyridine

C7H8N4O — CID 151655403

IUPAC3-azido-6-methoxy-2-methylpyridine
SMILESCOc1ccc(N=[N+]=[N-])c(C)n1
InChIInChI=1S/C7H8N4O/c1-5-6(10-11-8)3-4-7(9-5)12-2/h3-4H,1-2H3
InChIKeyQVJUQGUIEGRSGY-UHFFFAOYSA-N
MW164.17 g/mol
LogP2.34
Rot. Bonds2

About 3-azido-6-methoxy-2-methylpyridine

3-azido-6-methoxy-2-methylpyridine (PubChem CID 151655403) has the molecular formula C7H8N4O and a molecular weight of 164.17 g/mol. Its IUPAC name is 3-azido-6-methoxy-2-methylpyridine.

Molecular Properties

Compound Name3-azido-6-methoxy-2-methylpyridine
PubChem CID151655403
Molecular FormulaC7H8N4O
Molecular Weight164.17 g/mol
Exact Mass164.07
IUPAC Name3-azido-6-methoxy-2-methylpyridine
SMILESCOc1ccc(N=[N+]=[N-])c(C)n1
InChIInChI=1S/C7H8N4O/c1-5-6(10-11-8)3-4-7(9-5)12-2/h3-4H,1-2H3
InChIKeyQVJUQGUIEGRSGY-UHFFFAOYSA-N
XLogP2.34
TPSA70.88 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.17
LogP ≤ 52.34
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 3-azido-6-methoxy-2-methylpyridine?
The IUPAC name of 3-azido-6-methoxy-2-methylpyridine (CID 151655403) is 3-azido-6-methoxy-2-methylpyridine.
What is the SMILES notation for 3-azido-6-methoxy-2-methylpyridine?
The canonical SMILES for 3-azido-6-methoxy-2-methylpyridine is COc1ccc(N=[N+]=[N-])c(C)n1.
What is the InChIKey of 3-azido-6-methoxy-2-methylpyridine?
The InChIKey is QVJUQGUIEGRSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O/c1-5-6(10-11-8)3-4-7(9-5)12-2/h3-4H,1-2H3.
What are the key properties of 3-azido-6-methoxy-2-methylpyridine?
3-azido-6-methoxy-2-methylpyridine has a molecular weight of 164.17 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azido-6-methoxy-2-methylpyridine is sourced from PubChem (CID 151655403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).