6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride

C19H19ClFN5OS — CID 153383156

IUPAC6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride
SMILESCl.Cn1cc2cc(-c3cc4sc(OC5CCNCC5)nc4cn3)cc(F)c2n1
InChIInChI=1S/C19H18FN5OS.ClH/c1-25-10-12-6-11(7-14(20)18(12)24-25)15-8-17-16(9-22-15)23-19(27-17)26-13-2-4-21-5-3-13;/h6-10,13,21H,2-5H2,1H3;1H
InChIKeyLGRHXSIVFHPQLB-UHFFFAOYSA-N
MW419.91 g/mol
LogP3.94
Rot. Bonds3

About 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride

6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride (PubChem CID 153383156) has the molecular formula C19H19ClFN5OS and a molecular weight of 419.91 g/mol. Its IUPAC name is 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride.

Molecular Properties

Compound Name6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride
PubChem CID153383156
Molecular FormulaC19H19ClFN5OS
Molecular Weight419.91 g/mol
Exact Mass419.10
IUPAC Name6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride
SMILESCl.Cn1cc2cc(-c3cc4sc(OC5CCNCC5)nc4cn3)cc(F)c2n1
InChIInChI=1S/C19H18FN5OS.ClH/c1-25-10-12-6-11(7-14(20)18(12)24-25)15-8-17-16(9-22-15)23-19(27-17)26-13-2-4-21-5-3-13;/h6-10,13,21H,2-5H2,1H3;1H
InChIKeyLGRHXSIVFHPQLB-UHFFFAOYSA-N
XLogP3.94
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.91
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride?
The IUPAC name of 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride (CID 153383156) is 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride.
What is the SMILES notation for 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride?
The canonical SMILES for 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride is Cl.Cn1cc2cc(-c3cc4sc(OC5CCNCC5)nc4cn3)cc(F)c2n1.
What is the InChIKey of 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride?
The InChIKey is LGRHXSIVFHPQLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN5OS.ClH/c1-25-10-12-6-11(7-14(20)18(12)24-25)15-8-17-16(9-22-15)23-19(27-17)26-13-2-4-21-5-3-13;/h6-10,13,21H,2-5H2,1H3;1H.
What are the key properties of 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride?
6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride has a molecular weight of 419.91 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride is sourced from PubChem (CID 153383156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).