6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide

C17H12FN5O2S — CID 118103919

IUPAC6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide
SMILESCc1csc(NC(=O)c2cc(Oc3cncc(F)c3)cn3ccnc23)n1
InChIInChI=1S/C17H12FN5O2S/c1-10-9-26-17(21-10)22-16(24)14-5-13(8-23-3-2-20-15(14)23)25-12-4-11(18)6-19-7-12/h2-9H,1H3,(H,21,22,24)
InChIKeyPISHOGBTJJLPRV-UHFFFAOYSA-N
MW369.38 g/mol
LogP3.68
Rot. Bonds4

About 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide

6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide (PubChem CID 118103919) has the molecular formula C17H12FN5O2S and a molecular weight of 369.38 g/mol. Its IUPAC name is 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide.

Molecular Properties

Compound Name6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide
PubChem CID118103919
Molecular FormulaC17H12FN5O2S
Molecular Weight369.38 g/mol
Exact Mass369.07
IUPAC Name6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide
SMILESCc1csc(NC(=O)c2cc(Oc3cncc(F)c3)cn3ccnc23)n1
InChIInChI=1S/C17H12FN5O2S/c1-10-9-26-17(21-10)22-16(24)14-5-13(8-23-3-2-20-15(14)23)25-12-4-11(18)6-19-7-12/h2-9H,1H3,(H,21,22,24)
InChIKeyPISHOGBTJJLPRV-UHFFFAOYSA-N
XLogP3.68
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.38
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The IUPAC name of 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide (CID 118103919) is 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide.
What is the SMILES notation for 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The canonical SMILES for 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide is Cc1csc(NC(=O)c2cc(Oc3cncc(F)c3)cn3ccnc23)n1.
What is the InChIKey of 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The InChIKey is PISHOGBTJJLPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FN5O2S/c1-10-9-26-17(21-10)22-16(24)14-5-13(8-23-3-2-20-15(14)23)25-12-4-11(18)6-19-7-12/h2-9H,1H3,(H,21,22,24).
What are the key properties of 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide?
6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide has a molecular weight of 369.38 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide is sourced from PubChem (CID 118103919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).