5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole

C18H18FN5S — CID 162432938

IUPAC5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole
SMILESCc1cn2cc(-c3cc4cn(C5CCNCC5)nc4s3)cc(F)c2n1
InChIInChI=1S/C18H18FN5S/c1-11-8-23-9-12(6-15(19)17(23)21-11)16-7-13-10-24(22-18(13)25-16)14-2-4-20-5-3-14/h6-10,14,20H,2-5H2,1H3
InChIKeyQKMHPDLMZJRJGK-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.78
Rot. Bonds2

About 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole

5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole (PubChem CID 162432938) has the molecular formula C18H18FN5S and a molecular weight of 355.44 g/mol. Its IUPAC name is 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole.

Molecular Properties

Compound Name5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole
PubChem CID162432938
Molecular FormulaC18H18FN5S
Molecular Weight355.44 g/mol
Exact Mass355.13
IUPAC Name5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole
SMILESCc1cn2cc(-c3cc4cn(C5CCNCC5)nc4s3)cc(F)c2n1
InChIInChI=1S/C18H18FN5S/c1-11-8-23-9-12(6-15(19)17(23)21-11)16-7-13-10-24(22-18(13)25-16)14-2-4-20-5-3-14/h6-10,14,20H,2-5H2,1H3
InChIKeyQKMHPDLMZJRJGK-UHFFFAOYSA-N
XLogP3.78
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole?
The IUPAC name of 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole (CID 162432938) is 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole.
What is the SMILES notation for 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole?
The canonical SMILES for 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole is Cc1cn2cc(-c3cc4cn(C5CCNCC5)nc4s3)cc(F)c2n1.
What is the InChIKey of 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole?
The InChIKey is QKMHPDLMZJRJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN5S/c1-11-8-23-9-12(6-15(19)17(23)21-11)16-7-13-10-24(22-18(13)25-16)14-2-4-20-5-3-14/h6-10,14,20H,2-5H2,1H3.
What are the key properties of 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole?
5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole has a molecular weight of 355.44 g/mol, XLogP of 3.78, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylthieno[2,3-c]pyrazole is sourced from PubChem (CID 162432938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).