6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide

C20H13FN6OS — CID 23537390

IUPAC6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide
SMILESNC(=O)c1cc(-c2cn[nH]c2-c2ccc(F)cc2)cn2c(-c3nccs3)cnc12
InChIInChI=1S/C20H13FN6OS/c21-13-3-1-11(2-4-13)17-15(8-25-26-17)12-7-14(18(22)28)19-24-9-16(27(19)10-12)20-23-5-6-29-20/h1-10H,(H2,22,28)(H,25,26)
InChIKeySLTNOQFAKKVPRS-UHFFFAOYSA-N
MW404.43 g/mol
LogP3.75
Rot. Bonds4

About 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide

6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide (PubChem CID 23537390) has the molecular formula C20H13FN6OS and a molecular weight of 404.43 g/mol. Its IUPAC name is 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide.

Molecular Properties

Compound Name6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide
PubChem CID23537390
Molecular FormulaC20H13FN6OS
Molecular Weight404.43 g/mol
Exact Mass404.09
IUPAC Name6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide
SMILESNC(=O)c1cc(-c2cn[nH]c2-c2ccc(F)cc2)cn2c(-c3nccs3)cnc12
InChIInChI=1S/C20H13FN6OS/c21-13-3-1-11(2-4-13)17-15(8-25-26-17)12-7-14(18(22)28)19-24-9-16(27(19)10-12)20-23-5-6-29-20/h1-10H,(H2,22,28)(H,25,26)
InChIKeySLTNOQFAKKVPRS-UHFFFAOYSA-N
XLogP3.75
TPSA101.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.43
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The IUPAC name of 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide (CID 23537390) is 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide.
What is the SMILES notation for 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The canonical SMILES for 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide is NC(=O)c1cc(-c2cn[nH]c2-c2ccc(F)cc2)cn2c(-c3nccs3)cnc12.
What is the InChIKey of 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The InChIKey is SLTNOQFAKKVPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13FN6OS/c21-13-3-1-11(2-4-13)17-15(8-25-26-17)12-7-14(18(22)28)19-24-9-16(27(19)10-12)20-23-5-6-29-20/h1-10H,(H2,22,28)(H,25,26).
What are the key properties of 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide?
6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide has a molecular weight of 404.43 g/mol, XLogP of 3.75, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-8-carboxamide is sourced from PubChem (CID 23537390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).