2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide

C24H19FN6O — CID 23537310

IUPAC2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide
SMILESCc1ccnc(NC(=O)c2ccc(-c3cnc4ccc(-c5cn[nH]c5C)cn34)cc2F)c1
InChIInChI=1S/C24H19FN6O/c1-14-7-8-26-22(9-14)29-24(32)18-5-3-16(10-20(18)25)21-12-27-23-6-4-17(13-31(21)23)19-11-28-30-15(19)2/h3-13H,1-2H3,(H,28,30)(H,26,29,32)
InChIKeyVMSTYZGNVDQDDH-UHFFFAOYSA-N
MW426.46 g/mol
LogP4.79
Rot. Bonds4

About 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide

2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide (PubChem CID 23537310) has the molecular formula C24H19FN6O and a molecular weight of 426.46 g/mol. Its IUPAC name is 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide
PubChem CID23537310
Molecular FormulaC24H19FN6O
Molecular Weight426.46 g/mol
Exact Mass426.16
IUPAC Name2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide
SMILESCc1ccnc(NC(=O)c2ccc(-c3cnc4ccc(-c5cn[nH]c5C)cn34)cc2F)c1
InChIInChI=1S/C24H19FN6O/c1-14-7-8-26-22(9-14)29-24(32)18-5-3-16(10-20(18)25)21-12-27-23-6-4-17(13-31(21)23)19-11-28-30-15(19)2/h3-13H,1-2H3,(H,28,30)(H,26,29,32)
InChIKeyVMSTYZGNVDQDDH-UHFFFAOYSA-N
XLogP4.79
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.46
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide?
The IUPAC name of 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide (CID 23537310) is 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide is Cc1ccnc(NC(=O)c2ccc(-c3cnc4ccc(-c5cn[nH]c5C)cn34)cc2F)c1.
What is the InChIKey of 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide?
The InChIKey is VMSTYZGNVDQDDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN6O/c1-14-7-8-26-22(9-14)29-24(32)18-5-3-16(10-20(18)25)21-12-27-23-6-4-17(13-31(21)23)19-11-28-30-15(19)2/h3-13H,1-2H3,(H,28,30)(H,26,29,32).
What are the key properties of 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide?
2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide has a molecular weight of 426.46 g/mol, XLogP of 4.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 23537310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).