5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline

C11H10FN5O2 — CID 23297968

IUPAC5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline
SMILESCOc1nc2cc(F)cc(CN=[N+]=[N-])c2nc1OC
InChIInChI=1S/C11H10FN5O2/c1-18-10-11(19-2)16-9-6(5-14-17-13)3-7(12)4-8(9)15-10/h3-4H,5H2,1-2H3
InChIKeyOKCLJPNHVQXYQL-UHFFFAOYSA-N
MW263.23 g/mol
LogP2.60
Rot. Bonds4

About 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline

5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline (PubChem CID 23297968) has the molecular formula C11H10FN5O2 and a molecular weight of 263.23 g/mol. Its IUPAC name is 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline.

Molecular Properties

Compound Name5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline
PubChem CID23297968
Molecular FormulaC11H10FN5O2
Molecular Weight263.23 g/mol
Exact Mass263.08
IUPAC Name5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline
SMILESCOc1nc2cc(F)cc(CN=[N+]=[N-])c2nc1OC
InChIInChI=1S/C11H10FN5O2/c1-18-10-11(19-2)16-9-6(5-14-17-13)3-7(12)4-8(9)15-10/h3-4H,5H2,1-2H3
InChIKeyOKCLJPNHVQXYQL-UHFFFAOYSA-N
XLogP2.60
TPSA93.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.23
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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'}

Analyze 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline?
The IUPAC name of 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline (CID 23297968) is 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline.
What is the SMILES notation for 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline?
The canonical SMILES for 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline is COc1nc2cc(F)cc(CN=[N+]=[N-])c2nc1OC.
What is the InChIKey of 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline?
The InChIKey is OKCLJPNHVQXYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN5O2/c1-18-10-11(19-2)16-9-6(5-14-17-13)3-7(12)4-8(9)15-10/h3-4H,5H2,1-2H3.
What are the key properties of 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline?
5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline has a molecular weight of 263.23 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(azidomethyl)-7-fluoro-2,3-dimethoxyquinoxaline is sourced from PubChem (CID 23297968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).