ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene

C68H72F3N13O10 — CID 167630878

IUPACethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene
SMILESCCOC(=O)COc1ccc(-c2cnc3cnccn23)cn1.CCOC(=O)COc1ccc(C2OC(C)(C)C(C)(C)O2)cn1.Cc1ccc(C)c(C)c1.Cc1cnc(CC(=O)COc2ccc(-c3cnc4cnccn34)cn2)cc1C(F)(F)F.Cc1cnc2cnccn12
InChIInChI=1S/C21H16F3N5O2.C16H23NO5.C15H14N4O3.C9H12.C7H7N3/c1-13-8-26-15(7-17(13)21(22,23)24)6-16(30)12-31-20-3-2-14(9-28-20)18-10-27-19-11-25-4-5-29(18)19;1-6-19-13(18)10-20-12-8-7-11(9-17-12)14-21-15(2,3)16(4,5)22-14;1-2-21-15(20)10-22-14-4-3-11(7-18-14)12-8-17-13-9-16-5-6-19(12)13;1-7-4-5-8(2)9(3)6-7;1-6-4-9-7-5-8-2-3-10(6)7/h2-5,7-11H,6,12H2,1H3;7-9,14H,6,10H2,1-5H3;3-9H,2,10H2,1H3;4-6H,1-3H3;2-5H,1H3
InChIKeyNTWMTBLHEHZMNF-UHFFFAOYSA-N
MW1288.40 g/mol
LogP11.71
Rot. Bonds16

About ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene

ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene (PubChem CID 167630878) has the molecular formula C68H72F3N13O10 and a molecular weight of 1288.40 g/mol. Its IUPAC name is ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene.

Molecular Properties

Compound Nameethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene
PubChem CID167630878
Molecular FormulaC68H72F3N13O10
Molecular Weight1288.40 g/mol
Exact Mass1287.55
IUPAC Nameethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene
SMILESCCOC(=O)COc1ccc(-c2cnc3cnccn23)cn1.CCOC(=O)COc1ccc(C2OC(C)(C)C(C)(C)O2)cn1.Cc1ccc(C)c(C)c1.Cc1cnc(CC(=O)COc2ccc(-c3cnc4cnccn34)cn2)cc1C(F)(F)F.Cc1cnc2cnccn12
InChIInChI=1S/C21H16F3N5O2.C16H23NO5.C15H14N4O3.C9H12.C7H7N3/c1-13-8-26-15(7-17(13)21(22,23)24)6-16(30)12-31-20-3-2-14(9-28-20)18-10-27-19-11-25-4-5-29(18)19;1-6-19-13(18)10-20-12-8-7-11(9-17-12)14-21-15(2,3)16(4,5)22-14;1-2-21-15(20)10-22-14-4-3-11(7-18-14)12-8-17-13-9-16-5-6-19(12)13;1-7-4-5-8(2)9(3)6-7;1-6-4-9-7-5-8-2-3-10(6)7/h2-5,7-11H,6,12H2,1H3;7-9,14H,6,10H2,1-5H3;3-9H,2,10H2,1H3;4-6H,1-3H3;2-5H,1H3
InChIKeyNTWMTBLHEHZMNF-UHFFFAOYSA-N
XLogP11.71
TPSA257.95 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds16
Heavy Atoms94
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001288.40
LogP ≤ 511.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene with MolForge

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Related Compounds

2-[(5-Imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]acetic acid;1-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;4-methyl-3-(trifluoromethyl)aniline
CID 167565665
ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methyl-3aH-pyrrolo[2,3-c]pyridine;2,4,5-trimethylpyridine
CID 167640821
3-Bromoimidazo[1,2-a]pyrazine;1-(3,4-dimethylphenyl)-3-(4-imidazo[1,2-a]pyrazin-3-ylphenoxy)propan-2-one;ethyl propanoate;2-(4-imidazo[1,2-a]pyrazin-3-ylphenoxy)acetic acid;1-(4-methylphenyl)ethanol;3-(4-methylphenyl)imidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene
CID 167604676

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene?
The IUPAC name of ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene (CID 167630878) is ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene.
What is the SMILES notation for ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene?
The canonical SMILES for ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene is CCOC(=O)COc1ccc(-c2cnc3cnccn23)cn1.CCOC(=O)COc1ccc(C2OC(C)(C)C(C)(C)O2)cn1.Cc1ccc(C)c(C)c1.Cc1cnc(CC(=O)COc2ccc(-c3cnc4cnccn34)cn2)cc1C(F)(F)F.Cc1cnc2cnccn12.
What is the InChIKey of ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene?
The InChIKey is NTWMTBLHEHZMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F3N5O2.C16H23NO5.C15H14N4O3.C9H12.C7H7N3/c1-13-8-26-15(7-17(13)21(22,23)24)6-16(30)12-31-20-3-2-14(9-28-20)18-10-27-19-11-25-4-5-29(18)19;1-6-19-13(18)10-20-12-8-7-11(9-17-12)14-21-15(2,3)16(4,5)22-14;1-2-21-15(20)10-22-14-4-3-11(7-18-14)12-8-17-13-9-16-5-6-19(12)13;1-7-4-5-8(2)9(3)6-7;1-6-4-9-7-5-8-2-3-10(6)7/h2-5,7-11H,6,12H2,1H3;7-9,14H,6,10H2,1-5H3;3-9H,2,10H2,1H3;4-6H,1-3H3;2-5H,1H3.
What are the key properties of ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene?
ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene has a molecular weight of 1288.40 g/mol, XLogP of 11.71, 16 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]acetate;ethyl 2-[[5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)-2-pyridinyl]oxy]acetate;1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]propan-2-one;3-methylimidazo[1,2-a]pyrazine;1,2,4-trimethylbenzene is sourced from PubChem (CID 167630878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).