4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide

C19H15FN4O2S — CID 66856081

IUPAC4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide
SMILESCOc1cccc(F)c1-c1nc(-c2c(C)nn3ccccc23)sc1C(N)=O
InChIInChI=1S/C19H15FN4O2S/c1-10-14(12-7-3-4-9-24(12)23-10)19-22-16(17(27-19)18(21)25)15-11(20)6-5-8-13(15)26-2/h3-9H,1-2H3,(H2,21,25)
InChIKeyROEHWDAOVWMEHZ-UHFFFAOYSA-N
MW382.42 g/mol
LogP3.68
Rot. Bonds4

About 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide

4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide (PubChem CID 66856081) has the molecular formula C19H15FN4O2S and a molecular weight of 382.42 g/mol. Its IUPAC name is 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide
PubChem CID66856081
Molecular FormulaC19H15FN4O2S
Molecular Weight382.42 g/mol
Exact Mass382.09
IUPAC Name4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide
SMILESCOc1cccc(F)c1-c1nc(-c2c(C)nn3ccccc23)sc1C(N)=O
InChIInChI=1S/C19H15FN4O2S/c1-10-14(12-7-3-4-9-24(12)23-10)19-22-16(17(27-19)18(21)25)15-11(20)6-5-8-13(15)26-2/h3-9H,1-2H3,(H2,21,25)
InChIKeyROEHWDAOVWMEHZ-UHFFFAOYSA-N
XLogP3.68
TPSA82.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide (CID 66856081) is 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide is COc1cccc(F)c1-c1nc(-c2c(C)nn3ccccc23)sc1C(N)=O.
What is the InChIKey of 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is ROEHWDAOVWMEHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O2S/c1-10-14(12-7-3-4-9-24(12)23-10)19-22-16(17(27-19)18(21)25)15-11(20)6-5-8-13(15)26-2/h3-9H,1-2H3,(H2,21,25).
What are the key properties of 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide?
4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 382.42 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-6-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 66856081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).