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

C18H18FN5S — CID 162433074

IUPAC2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole
SMILESCc1cn2cc(-n3cc4cc(C5CCNCC5)sc4n3)cc(F)c2n1
InChIInChI=1S/C18H18FN5S/c1-11-8-23-10-14(7-15(19)17(23)21-11)24-9-13-6-16(25-18(13)22-24)12-2-4-20-5-3-12/h6-10,12,20H,2-5H2,1H3
InChIKeyYNBVMMHSSOTHAI-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.65
Rot. Bonds2

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

2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole (PubChem CID 162433074) has the molecular formula C18H18FN5S and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole.

Molecular Properties

Compound Name2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole
PubChem CID162433074
Molecular FormulaC18H18FN5S
Molecular Weight355.44 g/mol
Exact Mass355.13
IUPAC Name2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole
SMILESCc1cn2cc(-n3cc4cc(C5CCNCC5)sc4n3)cc(F)c2n1
InChIInChI=1S/C18H18FN5S/c1-11-8-23-10-14(7-15(19)17(23)21-11)24-9-13-6-16(25-18(13)22-24)12-2-4-20-5-3-12/h6-10,12,20H,2-5H2,1H3
InChIKeyYNBVMMHSSOTHAI-UHFFFAOYSA-N
XLogP3.65
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 ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole?
The IUPAC name of 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole (CID 162433074) is 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole.
What is the SMILES notation for 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole?
The canonical SMILES for 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole is Cc1cn2cc(-n3cc4cc(C5CCNCC5)sc4n3)cc(F)c2n1.
What is the InChIKey of 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole?
The InChIKey is YNBVMMHSSOTHAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN5S/c1-11-8-23-10-14(7-15(19)17(23)21-11)24-9-13-6-16(25-18(13)22-24)12-2-4-20-5-3-12/h6-10,12,20H,2-5H2,1H3.
What are the key properties of 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole?
2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole has a molecular weight of 355.44 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthieno[2,3-c]pyrazole is sourced from PubChem (CID 162433074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).