6-fluoro-3-(2H-tetrazol-5-yl)quinoline

C10H6FN5 — CID 90668424

IUPAC6-fluoro-3-(2H-tetrazol-5-yl)quinoline
SMILESFc1ccc2ncc(-c3nn[nH]n3)cc2c1
InChIInChI=1S/C10H6FN5/c11-8-1-2-9-6(4-8)3-7(5-12-9)10-13-15-16-14-10/h1-5H,(H,13,14,15,16)
InChIKeyPRIWVLMENDJODM-UHFFFAOYSA-N
MW215.19 g/mol
LogP1.55
Rot. Bonds1

About 6-fluoro-3-(2H-tetrazol-5-yl)quinoline

6-fluoro-3-(2H-tetrazol-5-yl)quinoline (PubChem CID 90668424) has the molecular formula C10H6FN5 and a molecular weight of 215.19 g/mol. Its IUPAC name is 6-fluoro-3-(2H-tetrazol-5-yl)quinoline.

Molecular Properties

Compound Name6-fluoro-3-(2H-tetrazol-5-yl)quinoline
PubChem CID90668424
Molecular FormulaC10H6FN5
Molecular Weight215.19 g/mol
Exact Mass215.06
IUPAC Name6-fluoro-3-(2H-tetrazol-5-yl)quinoline
SMILESFc1ccc2ncc(-c3nn[nH]n3)cc2c1
InChIInChI=1S/C10H6FN5/c11-8-1-2-9-6(4-8)3-7(5-12-9)10-13-15-16-14-10/h1-5H,(H,13,14,15,16)
InChIKeyPRIWVLMENDJODM-UHFFFAOYSA-N
XLogP1.55
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.19
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-(2H-tetrazol-5-yl)quinoline?
The IUPAC name of 6-fluoro-3-(2H-tetrazol-5-yl)quinoline (CID 90668424) is 6-fluoro-3-(2H-tetrazol-5-yl)quinoline.
What is the SMILES notation for 6-fluoro-3-(2H-tetrazol-5-yl)quinoline?
The canonical SMILES for 6-fluoro-3-(2H-tetrazol-5-yl)quinoline is Fc1ccc2ncc(-c3nn[nH]n3)cc2c1.
What is the InChIKey of 6-fluoro-3-(2H-tetrazol-5-yl)quinoline?
The InChIKey is PRIWVLMENDJODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6FN5/c11-8-1-2-9-6(4-8)3-7(5-12-9)10-13-15-16-14-10/h1-5H,(H,13,14,15,16).
What are the key properties of 6-fluoro-3-(2H-tetrazol-5-yl)quinoline?
6-fluoro-3-(2H-tetrazol-5-yl)quinoline has a molecular weight of 215.19 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-(2H-tetrazol-5-yl)quinoline is sourced from PubChem (CID 90668424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).