8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one

C21H12F3N5O2 — CID 118426615

IUPAC8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one
SMILESO=c1c2nccnc2c(-c2ccc3nccn3c2)cn1-c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C21H12F3N5O2/c22-21(23,24)31-15-4-2-14(3-5-15)29-12-16(18-19(20(29)30)27-8-7-26-18)13-1-6-17-25-9-10-28(17)11-13/h1-12H
InChIKeyKDLCAGXMPCRLDY-UHFFFAOYSA-N
MW423.35 g/mol
LogP3.99
Rot. Bonds3

About 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one

8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one (PubChem CID 118426615) has the molecular formula C21H12F3N5O2 and a molecular weight of 423.35 g/mol. Its IUPAC name is 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one.

Molecular Properties

Compound Name8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one
PubChem CID118426615
Molecular FormulaC21H12F3N5O2
Molecular Weight423.35 g/mol
Exact Mass423.09
IUPAC Name8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one
SMILESO=c1c2nccnc2c(-c2ccc3nccn3c2)cn1-c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C21H12F3N5O2/c22-21(23,24)31-15-4-2-14(3-5-15)29-12-16(18-19(20(29)30)27-8-7-26-18)13-1-6-17-25-9-10-28(17)11-13/h1-12H
InChIKeyKDLCAGXMPCRLDY-UHFFFAOYSA-N
XLogP3.99
TPSA74.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.35
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one with MolForge

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Related Compounds

6-(azetidin-3-yl)-8-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one
CID 168825421
5-(4-chlorophenyl)-2,3-dimethyl-7-[4-(trifluoromethoxy)phenyl]-1,7-naphthyridin-8-one
CID 168887039
1-(trideuteriomethyl)-7-[1-(trideuteriomethyl)pyrazol-4-yl]-5-[4-(trifluoromethoxy)phenyl]imidazo[4,5-c]pyridin-4-one
CID 91938044
5-(2-fluorophenyl)-1-[4-(trifluoromethoxy)phenyl]pyridin-2-one
CID 58016353
[8-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-6-yl]methanamine
CID 168825688
7-(trifluoromethoxy)imidazo[1,2-a]pyridine
CID 91439341
1-iodo-2-[4-(trifluoromethoxy)phenyl]imidazole
CID 174608293
6-[3-(4-fluorophenyl)-5-methylimidazol-4-yl]imidazo[1,2-a]pyridine
CID 171799268
4-imidazo[1,2-a]pyridin-6-ylbenzoic acid
CID 82063340
3-methyl-6-[4-methyl-6-oxo-1-[4-(trifluoromethoxy)phenyl]-3-pyridinyl]-1,3-benzoxazol-2-one
CID 163493661
N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine
CID 106557401
2-pyridin-2-yl-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
CID 56596081

Frequently Asked Questions

What is the IUPAC name of 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one?
The IUPAC name of 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one (CID 118426615) is 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one.
What is the SMILES notation for 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one?
The canonical SMILES for 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one is O=c1c2nccnc2c(-c2ccc3nccn3c2)cn1-c1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one?
The InChIKey is KDLCAGXMPCRLDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H12F3N5O2/c22-21(23,24)31-15-4-2-14(3-5-15)29-12-16(18-19(20(29)30)27-8-7-26-18)13-1-6-17-25-9-10-28(17)11-13/h1-12H.
What are the key properties of 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one?
8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one has a molecular weight of 423.35 g/mol, XLogP of 3.99, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-imidazo[1,2-a]pyridin-6-yl-6-[4-(trifluoromethoxy)phenyl]pyrido[3,4-b]pyrazin-5-one is sourced from PubChem (CID 118426615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).