5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide

C22H20F3N7O3 — CID 150344506

IUPAC5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide
SMILESCOc1nc(C)c(-c2ccn3nc(N)nc3c2)cc1C(=O)NCc1ncccc1OCC(F)(F)F
InChIInChI=1S/C22H20F3N7O3/c1-12-14(13-5-7-32-18(8-13)30-21(26)31-32)9-15(20(29-12)34-2)19(33)28-10-16-17(4-3-6-27-16)35-11-22(23,24)25/h3-9H,10-11H2,1-2H3,(H2,26,31)(H,28,33)
InChIKeyGSKGBAQDNGSOBC-UHFFFAOYSA-N
MW487.44 g/mol
LogP2.96
Rot. Bonds7

About 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide

5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide (PubChem CID 150344506) has the molecular formula C22H20F3N7O3 and a molecular weight of 487.44 g/mol. Its IUPAC name is 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide
PubChem CID150344506
Molecular FormulaC22H20F3N7O3
Molecular Weight487.44 g/mol
Exact Mass487.16
IUPAC Name5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide
SMILESCOc1nc(C)c(-c2ccn3nc(N)nc3c2)cc1C(=O)NCc1ncccc1OCC(F)(F)F
InChIInChI=1S/C22H20F3N7O3/c1-12-14(13-5-7-32-18(8-13)30-21(26)31-32)9-15(20(29-12)34-2)19(33)28-10-16-17(4-3-6-27-16)35-11-22(23,24)25/h3-9H,10-11H2,1-2H3,(H2,26,31)(H,28,33)
InChIKeyGSKGBAQDNGSOBC-UHFFFAOYSA-N
XLogP2.96
TPSA129.55 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500487.44
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide with MolForge

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Related Compounds

5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[2-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide
CID 150259786
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[2-[3-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide
CID 152535099
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[[3-fluoro-2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-methoxy-6-methylpyridine-3-carboxamide
CID 135305038
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[[2-(3,3-difluoropyrrolidine-1-carbonyl)-5-fluorophenyl]methyl]-2-methoxy-6-methylpyridine-3-carboxamide
CID 151715212
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-methoxypyridine-3-carboxamide
CID 152703549
[2-[[[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxypyridine-3-carbonyl]amino]methyl]-5-fluorophenyl] N,N-dimethylcarbamate
CID 150572304
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-(deuteriomethoxy)-N-[1-[2-fluoro-5-(trifluoromethoxy)phenyl]ethyl]-6-methylpyridine-3-carboxamide
CID 135304985
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[(2-cyclopentyloxy-6-fluorophenyl)methyl]-2-methoxypyridine-3-carboxamide
CID 135304812
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[[4-fluoro-2-(oxolan-2-yloxy)phenyl]methyl]-2-methoxypyridine-3-carboxamide
CID 153302348
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[3-(4-fluorophenyl)-3-hydroxypropyl]-2-methoxypyridine-3-carboxamide
CID 135304837
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[[2-[[(2R)-2-bicyclo[2.2.1]heptanyl]oxy]-6-fluorophenyl]methyl]-2-methoxypyridine-3-carboxamide
CID 153302459
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[[2-(2-bicyclo[2.2.1]heptanyloxy)-6-fluorophenyl]methyl]-2-methoxypyridine-3-carboxamide
CID 142412296

Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide?
The IUPAC name of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide (CID 150344506) is 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide is COc1nc(C)c(-c2ccn3nc(N)nc3c2)cc1C(=O)NCc1ncccc1OCC(F)(F)F.
What is the InChIKey of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide?
The InChIKey is GSKGBAQDNGSOBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F3N7O3/c1-12-14(13-5-7-32-18(8-13)30-21(26)31-32)9-15(20(29-12)34-2)19(33)28-10-16-17(4-3-6-27-16)35-11-22(23,24)25/h3-9H,10-11H2,1-2H3,(H2,26,31)(H,28,33).
What are the key properties of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide?
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide has a molecular weight of 487.44 g/mol, XLogP of 2.96, 7 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-6-methyl-N-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 150344506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).