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

C17H12FN5OS — CID 171092153

IUPACN-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide
SMILESCc1ncc(-c2cc(C(=O)Nc3ccc(F)cn3)c3nccn3c2)s1
InChIInChI=1S/C17H12FN5OS/c1-10-20-8-14(25-10)11-6-13(16-19-4-5-23(16)9-11)17(24)22-15-3-2-12(18)7-21-15/h2-9H,1H3,(H,21,22,24)
InChIKeyBTXINJFGTHZBFX-UHFFFAOYSA-N
MW353.38 g/mol
LogP3.55
Rot. Bonds3

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

N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide (PubChem CID 171092153) has the molecular formula C17H12FN5OS and a molecular weight of 353.38 g/mol. Its IUPAC name is N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide
PubChem CID171092153
Molecular FormulaC17H12FN5OS
Molecular Weight353.38 g/mol
Exact Mass353.07
IUPAC NameN-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide
SMILESCc1ncc(-c2cc(C(=O)Nc3ccc(F)cn3)c3nccn3c2)s1
InChIInChI=1S/C17H12FN5OS/c1-10-20-8-14(25-10)11-6-13(16-19-4-5-23(16)9-11)17(24)22-15-3-2-12(18)7-21-15/h2-9H,1H3,(H,21,22,24)
InChIKeyBTXINJFGTHZBFX-UHFFFAOYSA-N
XLogP3.55
TPSA72.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The IUPAC name of N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide (CID 171092153) is N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The canonical SMILES for N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide is Cc1ncc(-c2cc(C(=O)Nc3ccc(F)cn3)c3nccn3c2)s1.
What is the InChIKey of N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide?
The InChIKey is BTXINJFGTHZBFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FN5OS/c1-10-20-8-14(25-10)11-6-13(16-19-4-5-23(16)9-11)17(24)22-15-3-2-12(18)7-21-15/h2-9H,1H3,(H,21,22,24).
What are the key properties of N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide?
N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-pyridinyl)-6-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-8-carboxamide is sourced from PubChem (CID 171092153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).