3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride

C87H72BCl6F10N26O8P — CID 157367375

About 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride

3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride (PubChem CID 157367375) has the molecular formula C87H72BCl6F10N26O8P and a molecular weight of 2054.19 g/mol. Its IUPAC name is 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride.

Molecular Properties

• Compound Name: 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride
• PubChem CID: 157367375
• Molecular Formula: C87H72BCl6F10N26O8P
• Molecular Weight: 2054.19 g/mol
• Exact Mass: 2050.38
• IUPAC Name: 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride
• SMILES: C.CN1CCC[C@@H]1C(=O)O.COC(=O)c1nc(Cl)c(-c2ccc(F)c(F)c2)nc1N.Cc1cnc2ccc(-c3nc(C#N)c(N)nc3-c3ccc(F)c(F)c3)cn12.Cc1cnc2ccc(-c3nc(CN)c(N)nc3-c3ccc(F)c(F)c3)cn12.Cc1cnc2ccc(B(O)O)cn12.N#Cc1nc(Cl)c(-c2ccc(F)c(F)c2)nc1N.NC(=O)c1nc(Cl)c(-c2ccc(F)c(F)c2)nc1N.O=P(Cl)(Cl)Cl
• InChI: InChI=1S/C19H16F2N6.C19H12F2N6.C12H8ClF2N3O2.C11H7ClF2N4O.C11H5ClF2N4.C8H9BN2O2.C6H11NO2.CH4.Cl3OP/c2*1-10-8-24-16-5-3-12(9-27(10)16)18-17(26-19(23)15(7-22)25-18)11-2-4-13(20)14(21)6-11;1-20-12(19)9-11(16)18-8(10(13)17-9)5-2-3-6(14)7(15)4-5;12-9-7(4-1-2-5(13)6(14)3-4)18-10(15)8(17-9)11(16)19;12-10-9(18-11(16)8(4-15)17-10)5-1-2-6(13)7(14)3-5;1-6-4-10-8-3-2-7(9(12)13)5-11(6)8;1-7-4-2-3-5(7)6(8)9;;1-5(2,3)4/h2-6,8-9H,7,22H2,1H3,(H2,23,26);2-6,8-9H,1H3,(H2,23,26);2-4H,1H3,(H2,16,18);1-3H,(H2,15,18)(H2,16,19);1-3H,(H2,16,18);2-5,12-13H,1H3;5H,2-4H2,1H3,(H,8,9);1H4;/t;;;;;;5-;;/m......1../s1
• InChIKey: BJIPPLAPQMDVLY-QPGSRBCJSA-N
• XLogP: 16.25
• TPSA: 551.96 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 32
• Rotatable Bonds: 12
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2054.19
LogP ≤ 5	16.25
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride?

The IUPAC name of 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride (CID 157367375) is 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride.

What is the SMILES notation for 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride?

The canonical SMILES for 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride is C.CN1CCC[C@@H]1C(=O)O.COC(=O)c1nc(Cl)c(-c2ccc(F)c(F)c2)nc1N.Cc1cnc2ccc(-c3nc(C#N)c(N)nc3-c3ccc(F)c(F)c3)cn12.Cc1cnc2ccc(-c3nc(CN)c(N)nc3-c3ccc(F)c(F)c3)cn12.Cc1cnc2ccc(B(O)O)cn12.N#Cc1nc(Cl)c(-c2ccc(F)c(F)c2)nc1N.NC(=O)c1nc(Cl)c(-c2ccc(F)c(F)c2)nc1N.O=P(Cl)(Cl)Cl.

What is the InChIKey of 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride?

The InChIKey is BJIPPLAPQMDVLY-QPGSRBCJSA-N. The full InChI is InChI=1S/C19H16F2N6.C19H12F2N6.C12H8ClF2N3O2.C11H7ClF2N4O.C11H5ClF2N4.C8H9BN2O2.C6H11NO2.CH4.Cl3OP/c2*1-10-8-24-16-5-3-12(9-27(10)16)18-17(26-19(23)15(7-22)25-18)11-2-4-13(20)14(21)6-11;1-20-12(19)9-11(16)18-8(10(13)17-9)5-2-3-6(14)7(15)4-5;12-9-7(4-1-2-5(13)6(14)3-4)18-10(15)8(17-9)11(16)19;12-10-9(18-11(16)8(4-15)17-10)5-1-2-6(13)7(14)3-5;1-6-4-10-8-3-2-7(9(12)13)5-11(6)8;1-7-4-2-3-5(7)6(8)9;;1-5(2,3)4/h2-6,8-9H,7,22H2,1H3,(H2,23,26);2-6,8-9H,1H3,(H2,23,26);2-4H,1H3,(H2,16,18);1-3H,(H2,15,18)(H2,16,19);1-3H,(H2,16,18);2-5,12-13H,1H3;5H,2-4H2,1H3,(H,8,9);1H4;/t;;;;;;5-;;/m......1../s1.

What are the key properties of 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride?

3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride has a molecular weight of 2054.19 g/mol, XLogP of 16.25, 12 rotatable bonds, 10 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carbonitrile;3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxamide;3-amino-5-(3,4-difluorophenyl)-6-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carbonitrile;3-(aminomethyl)-6-(3,4-difluorophenyl)-5-(3-methylimidazo[1,2-a]pyridin-6-yl)pyrazin-2-amine;methane;methyl 3-amino-6-chloro-5-(3,4-difluorophenyl)pyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;(2R)-1-methylpyrrolidine-2-carboxylic acid;phosphoryl trichloride is sourced from PubChem (CID 157367375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).