6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline

C21H16FN5 — CID 71666369

IUPAC6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline
SMILESCn1cc(-c2cc(F)c3ncc(Cc4ccc5ncccc5c4)n3c2)cn1
InChIInChI=1S/C21H16FN5/c1-26-12-17(10-25-26)16-9-19(22)21-24-11-18(27(21)13-16)8-14-4-5-20-15(7-14)3-2-6-23-20/h2-7,9-13H,8H2,1H3
InChIKeyMSHBPDQSLWXXAL-UHFFFAOYSA-N
MW357.39 g/mol
LogP4.01
Rot. Bonds3

About 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline

6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline (PubChem CID 71666369) has the molecular formula C21H16FN5 and a molecular weight of 357.39 g/mol. Its IUPAC name is 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline.

Molecular Properties

Compound Name6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline
PubChem CID71666369
Molecular FormulaC21H16FN5
Molecular Weight357.39 g/mol
Exact Mass357.14
IUPAC Name6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline
SMILESCn1cc(-c2cc(F)c3ncc(Cc4ccc5ncccc5c4)n3c2)cn1
InChIInChI=1S/C21H16FN5/c1-26-12-17(10-25-26)16-9-19(22)21-24-11-18(27(21)13-16)8-14-4-5-20-15(7-14)3-2-6-23-20/h2-7,9-13H,8H2,1H3
InChIKeyMSHBPDQSLWXXAL-UHFFFAOYSA-N
XLogP4.01
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.39
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline?
The IUPAC name of 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline (CID 71666369) is 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline.
What is the SMILES notation for 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline?
The canonical SMILES for 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline is Cn1cc(-c2cc(F)c3ncc(Cc4ccc5ncccc5c4)n3c2)cn1.
What is the InChIKey of 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline?
The InChIKey is MSHBPDQSLWXXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN5/c1-26-12-17(10-25-26)16-9-19(22)21-24-11-18(27(21)13-16)8-14-4-5-20-15(7-14)3-2-6-23-20/h2-7,9-13H,8H2,1H3.
What are the key properties of 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline?
6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline has a molecular weight of 357.39 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[8-fluoro-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]quinoline is sourced from PubChem (CID 71666369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).