2-(azidomethyl)-3-(4-fluorophenyl)indolizine

C15H11FN4 — CID 118607547

IUPAC2-(azidomethyl)-3-(4-fluorophenyl)indolizine
SMILES[N-]=[N+]=NCc1cc2ccccn2c1-c1ccc(F)cc1
InChIInChI=1S/C15H11FN4/c16-13-6-4-11(5-7-13)15-12(10-18-19-17)9-14-3-1-2-8-20(14)15/h1-9H,10H2
InChIKeyOGYHSQOKOKMJLE-UHFFFAOYSA-N
MW266.28 g/mol
LogP4.56
Rot. Bonds3

About 2-(azidomethyl)-3-(4-fluorophenyl)indolizine

2-(azidomethyl)-3-(4-fluorophenyl)indolizine (PubChem CID 118607547) has the molecular formula C15H11FN4 and a molecular weight of 266.28 g/mol. Its IUPAC name is 2-(azidomethyl)-3-(4-fluorophenyl)indolizine.

Molecular Properties

Compound Name2-(azidomethyl)-3-(4-fluorophenyl)indolizine
PubChem CID118607547
Molecular FormulaC15H11FN4
Molecular Weight266.28 g/mol
Exact Mass266.10
IUPAC Name2-(azidomethyl)-3-(4-fluorophenyl)indolizine
SMILES[N-]=[N+]=NCc1cc2ccccn2c1-c1ccc(F)cc1
InChIInChI=1S/C15H11FN4/c16-13-6-4-11(5-7-13)15-12(10-18-19-17)9-14-3-1-2-8-20(14)15/h1-9H,10H2
InChIKeyOGYHSQOKOKMJLE-UHFFFAOYSA-N
XLogP4.56
TPSA53.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Related Compounds

2-(2-azidoethyl)-3-phenylindolizine
CID 118607548
2-[(4-fluorophenyl)methyl]-3-phenylindolizine
CID 141353063
[3-(3-fluorophenyl)indolizin-2-yl]methanol
CID 118572939
1-(azidomethyl)-4-fluorobenzene
CID 11205864
1-(azidomethyl)-2-bromo-4-fluorobenzene
CID 43307115
1-(azidomethyl)-2,3-difluorobenzene
CID 21282623
4-(azidomethyl)-3-(4-fluorophenyl)benzamide
CID 122623216
4-(azidomethyl)-2-(4-fluorophenyl)-1,3-oxazole
CID 61373650
2-fluoroquinolizin-4-one
CID 90942420
1-(azidomethyl)-2,4-difluorobenzene;1-(chloromethyl)-2,4-difluorobenzene
CID 158479516
1-(azidomethyl)-2-methoxybenzene
CID 11263685
3-(azidomethyl)-7-fluoro-1-(2-fluorophenyl)-2H-quinoline
CID 141352873

Frequently Asked Questions

What is the IUPAC name of 2-(azidomethyl)-3-(4-fluorophenyl)indolizine?
The IUPAC name of 2-(azidomethyl)-3-(4-fluorophenyl)indolizine (CID 118607547) is 2-(azidomethyl)-3-(4-fluorophenyl)indolizine.
What is the SMILES notation for 2-(azidomethyl)-3-(4-fluorophenyl)indolizine?
The canonical SMILES for 2-(azidomethyl)-3-(4-fluorophenyl)indolizine is [N-]=[N+]=NCc1cc2ccccn2c1-c1ccc(F)cc1.
What is the InChIKey of 2-(azidomethyl)-3-(4-fluorophenyl)indolizine?
The InChIKey is OGYHSQOKOKMJLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4/c16-13-6-4-11(5-7-13)15-12(10-18-19-17)9-14-3-1-2-8-20(14)15/h1-9H,10H2.
What are the key properties of 2-(azidomethyl)-3-(4-fluorophenyl)indolizine?
2-(azidomethyl)-3-(4-fluorophenyl)indolizine has a molecular weight of 266.28 g/mol, XLogP of 4.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azidomethyl)-3-(4-fluorophenyl)indolizine is sourced from PubChem (CID 118607547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).