3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate

C63H48ClF2N23O11 — CID 157411439

IUPAC3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate
SMILESC.COC(=O)c1nc(-c2ccc3nccn3c2)c(-c2ncco2)nc1N.COC(=O)c1nc(Cl)c(-c2ncco2)nc1N.Nc1nc(-c2ncco2)c(-c2ccc3nccn3c2)nc1C(=O)NCc1c(F)cccc1F.Nc1nc(-c2ncco2)c(-c2ccc3nccn3c2)nc1C(=O)O
InChIInChI=1S/C22H15F2N7O2.C16H12N6O3.C15H10N6O3.C9H7ClN4O3.CH4/c23-14-2-1-3-15(24)13(14)10-28-21(32)19-20(25)30-18(22-27-7-9-33-22)17(29-19)12-4-5-16-26-6-8-31(16)11-12;1-24-16(23)13-14(17)21-12(15-19-5-7-25-15)11(20-13)9-2-3-10-18-4-6-22(10)8-9;16-13-12(15(22)23)19-10(11(20-13)14-18-4-6-24-14)8-1-2-9-17-3-5-21(9)7-8;1-16-9(15)5-7(11)14-4(6(10)13-5)8-12-2-3-17-8;/h1-9,11H,10H2,(H2,25,30)(H,28,32);2-8H,1H3,(H2,17,21);1-7H,(H2,16,20)(H,22,23);2-3H,1H3,(H2,11,14);1H4
InChIKeyBOIIUBHSXYHGCG-UHFFFAOYSA-N
MW1376.68 g/mol
LogP8.57
Rot. Bonds13

About 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate

3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate (PubChem CID 157411439) has the molecular formula C63H48ClF2N23O11 and a molecular weight of 1376.68 g/mol. Its IUPAC name is 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate.

Molecular Properties

Compound Name3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate
PubChem CID157411439
Molecular FormulaC63H48ClF2N23O11
Molecular Weight1376.68 g/mol
Exact Mass1375.36
IUPAC Name3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate
SMILESC.COC(=O)c1nc(-c2ccc3nccn3c2)c(-c2ncco2)nc1N.COC(=O)c1nc(Cl)c(-c2ncco2)nc1N.Nc1nc(-c2ncco2)c(-c2ccc3nccn3c2)nc1C(=O)NCc1c(F)cccc1F.Nc1nc(-c2ncco2)c(-c2ccc3nccn3c2)nc1C(=O)O
InChIInChI=1S/C22H15F2N7O2.C16H12N6O3.C15H10N6O3.C9H7ClN4O3.CH4/c23-14-2-1-3-15(24)13(14)10-28-21(32)19-20(25)30-18(22-27-7-9-33-22)17(29-19)12-4-5-16-26-6-8-31(16)11-12;1-24-16(23)13-14(17)21-12(15-19-5-7-25-15)11(20-13)9-2-3-10-18-4-6-22(10)8-9;16-13-12(15(22)23)19-10(11(20-13)14-18-4-6-24-14)8-1-2-9-17-3-5-21(9)7-8;1-16-9(15)5-7(11)14-4(6(10)13-5)8-12-2-3-17-8;/h1-9,11H,10H2,(H2,25,30)(H,28,32);2-8H,1H3,(H2,17,21);1-7H,(H2,16,20)(H,22,23);2-3H,1H3,(H2,11,14);1H4
InChIKeyBOIIUBHSXYHGCG-UHFFFAOYSA-N
XLogP8.57
TPSA482.22 Ų
H-Bond Donors6
H-Bond Acceptors32
Rotatable Bonds13
Heavy Atoms100
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001376.68
LogP ≤ 58.57
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1032

Analyze 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate?
The IUPAC name of 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate (CID 157411439) is 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate.
What is the SMILES notation for 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate?
The canonical SMILES for 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate is C.COC(=O)c1nc(-c2ccc3nccn3c2)c(-c2ncco2)nc1N.COC(=O)c1nc(Cl)c(-c2ncco2)nc1N.Nc1nc(-c2ncco2)c(-c2ccc3nccn3c2)nc1C(=O)NCc1c(F)cccc1F.Nc1nc(-c2ncco2)c(-c2ccc3nccn3c2)nc1C(=O)O.
What is the InChIKey of 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate?
The InChIKey is BOIIUBHSXYHGCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15F2N7O2.C16H12N6O3.C15H10N6O3.C9H7ClN4O3.CH4/c23-14-2-1-3-15(24)13(14)10-28-21(32)19-20(25)30-18(22-27-7-9-33-22)17(29-19)12-4-5-16-26-6-8-31(16)11-12;1-24-16(23)13-14(17)21-12(15-19-5-7-25-15)11(20-13)9-2-3-10-18-4-6-22(10)8-9;16-13-12(15(22)23)19-10(11(20-13)14-18-4-6-24-14)8-1-2-9-17-3-5-21(9)7-8;1-16-9(15)5-7(11)14-4(6(10)13-5)8-12-2-3-17-8;/h1-9,11H,10H2,(H2,25,30)(H,28,32);2-8H,1H3,(H2,17,21);1-7H,(H2,16,20)(H,22,23);2-3H,1H3,(H2,11,14);1H4.
What are the key properties of 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate?
3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate has a molecular weight of 1376.68 g/mol, XLogP of 8.57, 13 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(2,6-difluorophenyl)methyl]-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide;3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate;methyl 3-amino-6-imidazo[1,2-a]pyridin-6-yl-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylate is sourced from PubChem (CID 157411439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).