6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide

C53H34F8N8O2 — CID 160501547

IUPAC6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide
SMILESCc1ccc(-c2cccn3c(-c4cccc(F)c4F)cnc23)nc1C(=O)Nc1ccc(F)cc1.Cc1ccc(NC(=O)c2nc(-c3cccn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1
InChIInChI=1S/C27H17F5N4O.C26H17F3N4O/c1-15-7-9-16(10-8-15)34-26(37)24-19(27(30,31)32)11-12-21(35-24)17-5-3-13-36-22(14-33-25(17)36)18-4-2-6-20(28)23(18)29;1-15-7-12-21(32-24(15)26(34)31-17-10-8-16(27)9-11-17)18-5-3-13-33-22(14-30-25(18)33)19-4-2-6-20(28)23(19)29/h2-14H,1H3,(H,34,37);2-14H,1H3,(H,31,34)
InChIKeyQRVRVSZQKWONFU-UHFFFAOYSA-N
MW966.89 g/mol
LogP12.96
Rot. Bonds8

About 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide

6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 160501547) has the molecular formula C53H34F8N8O2 and a molecular weight of 966.89 g/mol. Its IUPAC name is 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID160501547
Molecular FormulaC53H34F8N8O2
Molecular Weight966.89 g/mol
Exact Mass966.27
IUPAC Name6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide
SMILESCc1ccc(-c2cccn3c(-c4cccc(F)c4F)cnc23)nc1C(=O)Nc1ccc(F)cc1.Cc1ccc(NC(=O)c2nc(-c3cccn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1
InChIInChI=1S/C27H17F5N4O.C26H17F3N4O/c1-15-7-9-16(10-8-15)34-26(37)24-19(27(30,31)32)11-12-21(35-24)17-5-3-13-36-22(14-33-25(17)36)18-4-2-6-20(28)23(18)29;1-15-7-12-21(32-24(15)26(34)31-17-10-8-16(27)9-11-17)18-5-3-13-33-22(14-30-25(18)33)19-4-2-6-20(28)23(19)29/h2-14H,1H3,(H,34,37);2-14H,1H3,(H,31,34)
InChIKeyQRVRVSZQKWONFU-UHFFFAOYSA-N
XLogP12.96
TPSA118.58 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500966.89
LogP ≤ 512.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide (CID 160501547) is 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide is Cc1ccc(-c2cccn3c(-c4cccc(F)c4F)cnc23)nc1C(=O)Nc1ccc(F)cc1.Cc1ccc(NC(=O)c2nc(-c3cccn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1.
What is the InChIKey of 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is QRVRVSZQKWONFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H17F5N4O.C26H17F3N4O/c1-15-7-9-16(10-8-15)34-26(37)24-19(27(30,31)32)11-12-21(35-24)17-5-3-13-36-22(14-33-25(17)36)18-4-2-6-20(28)23(18)29;1-15-7-12-21(32-24(15)26(34)31-17-10-8-16(27)9-11-17)18-5-3-13-33-22(14-30-25(18)33)19-4-2-6-20(28)23(19)29/h2-14H,1H3,(H,34,37);2-14H,1H3,(H,31,34).
What are the key properties of 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide?
6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 966.89 g/mol, XLogP of 12.96, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-3-methylpyridine-2-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 160501547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).