N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide

C36H25FN12O5 — CID 123767034

IUPACN-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESCc1nc(NC(=O)c2cc(Oc3cncc(COc4cccc(NC(=O)c5cc(Oc6cccnc6)cn6ncnc56)n4)c3)cn3ncnc23)ccc1F
InChIInChI=1S/C36H25FN12O5/c1-21-29(37)7-8-31(44-21)47-36(51)28-12-26(17-49-34(28)41-20-43-49)54-24-10-22(13-39-15-24)18-52-32-6-2-5-30(45-32)46-35(50)27-11-25(16-48-33(27)40-19-42-48)53-23-4-3-9-38-14-23/h2-17,19-20H,18H2,1H3,(H,44,47,51)(H,45,46,50)
InChIKeyVIRKAAYRHNGAOK-UHFFFAOYSA-N
MW724.67 g/mol
LogP5.47
Rot. Bonds11

About N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide

N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (PubChem CID 123767034) has the molecular formula C36H25FN12O5 and a molecular weight of 724.67 g/mol. Its IUPAC name is N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
PubChem CID123767034
Molecular FormulaC36H25FN12O5
Molecular Weight724.67 g/mol
Exact Mass724.21
IUPAC NameN-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESCc1nc(NC(=O)c2cc(Oc3cncc(COc4cccc(NC(=O)c5cc(Oc6cccnc6)cn6ncnc56)n4)c3)cn3ncnc23)ccc1F
InChIInChI=1S/C36H25FN12O5/c1-21-29(37)7-8-31(44-21)47-36(51)28-12-26(17-49-34(28)41-20-43-49)54-24-10-22(13-39-15-24)18-52-32-6-2-5-30(45-32)46-35(50)27-11-25(16-48-33(27)40-19-42-48)53-23-4-3-9-38-14-23/h2-17,19-20H,18H2,1H3,(H,44,47,51)(H,45,46,50)
InChIKeyVIRKAAYRHNGAOK-UHFFFAOYSA-N
XLogP5.47
TPSA197.83 Ų
H-Bond Donors2
H-Bond Acceptors15
Rotatable Bonds11
Heavy Atoms54
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500724.67
LogP ≤ 55.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1015

Analyze N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

Amg-337
CID 44181686
N-(5-fluoro-2-pyridinyl)-6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 91799365
N-(5-fluoro-2-pyridinyl)-6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 118096899
N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 118096900
N-[3-fluoro-4-[5-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrrolo[2,1-f][1,2,4]triazin-4-yl]oxyphenyl]pyridine-3-carboxamide
CID 11555216
N-(4-(6-(3-(dimethylamino)propoxy)-5-methylpyrrolo[1,2-f][1,2,4]triazin-4-yloxy)-3-fluorophenyl)nicotinamide
CID 21081793
6-[(4,5-difluoro-3-pyridinyl)oxy]-N-(5-fluoro-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 118103460
6-[(5-chloro-3-pyridinyl)oxy]-N-(5-fluoro-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 118103776
N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 118103837
6-[(5,6-difluoro-3-pyridinyl)oxy]-N-(5-fluoro-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 118103909
6-[(2,5-difluoro-3-pyridinyl)oxy]-N-(5-fluoro-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 118103959
6-[5-(difluoromethoxy)pyridin-3-yl]oxy-N-(5-fluoropyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 118103961

Frequently Asked Questions

What is the IUPAC name of N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The IUPAC name of N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (CID 123767034) is N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.
What is the SMILES notation for N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The canonical SMILES for N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is Cc1nc(NC(=O)c2cc(Oc3cncc(COc4cccc(NC(=O)c5cc(Oc6cccnc6)cn6ncnc56)n4)c3)cn3ncnc23)ccc1F.
What is the InChIKey of N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The InChIKey is VIRKAAYRHNGAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H25FN12O5/c1-21-29(37)7-8-31(44-21)47-36(51)28-12-26(17-49-34(28)41-20-43-49)54-24-10-22(13-39-15-24)18-52-32-6-2-5-30(45-32)46-35(50)27-11-25(16-48-33(27)40-19-42-48)53-23-4-3-9-38-14-23/h2-17,19-20H,18H2,1H3,(H,44,47,51)(H,45,46,50).
What are the key properties of N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide has a molecular weight of 724.67 g/mol, XLogP of 5.47, 11 rotatable bonds, 2 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[[5-[[8-[(5-fluoro-6-methyl-2-pyridinyl)carbamoyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]-3-pyridinyl]methoxy]-2-pyridinyl]-6-pyridin-3-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is sourced from PubChem (CID 123767034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).