2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide

C116H104F8N30O10 — CID 162214401

About 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide

2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide (PubChem CID 162214401) has the molecular formula C116H104F8N30O10 and a molecular weight of 2230.29 g/mol. Its IUPAC name is 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide.

Molecular Properties

• Compound Name: 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide
• PubChem CID: 162214401
• Molecular Formula: C116H104F8N30O10
• Molecular Weight: 2230.29 g/mol
• Exact Mass: 2228.84
• IUPAC Name: 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide
• SMILES: CC(C)N(C)c1nc2cc(C(=O)O)cnc2nc1-c1ccc(F)cc1.CC(C)N(C)c1nc2nc(C(=O)O)ccc2nc1C1CCCC1.CC1CCCN1c1nc2cc(-c3nn[nH]n3)cnc2nc1-c1ccc(F)cc1.CN(c1ccccc1)c1nc2cc(C(=O)O)c(C(F)(F)F)nc2nc1-c1ccc(F)cc1.COc1nc2nc(-c3ccc(F)cc3)c(N(C)c3cccnc3)nc2cc1C(=O)O.NC(=O)c1cnc2nc(-c3ccc(F)cc3)c(N3CCCCC3)nc2c1
• InChI: InChI=1S/C22H14F4N4O2.C21H16FN5O3.C19H17FN8.C19H18FN5O.C18H17FN4O2.C17H22N4O2/c1-30(14-5-3-2-4-6-14)20-17(12-7-9-13(23)10-8-12)28-19-16(27-20)11-15(21(31)32)18(29-19)22(24,25)26;1-27(14-4-3-9-23-11-14)19-17(12-5-7-13(22)8-6-12)25-18-16(24-19)10-15(21(28)29)20(26-18)30-2;1-11-3-2-8-28(11)19-16(12-4-6-14(20)7-5-12)23-18-15(22-19)9-13(10-21-18)17-24-26-27-25-17;20-14-6-4-12(5-7-14)16-19(25-8-2-1-3-9-25)23-15-10-13(17(21)26)11-22-18(15)24-16;1-10(2)23(3)17-15(11-4-6-13(19)7-5-11)22-16-14(21-17)8-12(9-20-16)18(24)25;1-10(2)21(3)16-14(11-6-4-5-7-11)18-12-8-9-13(17(22)23)19-15(12)20-16/h2-11H,1H3,(H,31,32);3-11H,1-2H3,(H,28,29);4-7,9-11H,2-3,8H2,1H3,(H,24,25,26,27);4-7,10-11H,1-3,8-9H2,(H2,21,26);4-10H,1-3H3,(H,24,25);8-11H,4-7H2,1-3H3,(H,22,23)
• InChIKey: ZTGTUHRPEMYMFB-UHFFFAOYSA-N
• XLogP: 21.54
• TPSA: 520.33 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 34
• Rotatable Bonds: 23
• Heavy Atoms: 164
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2230.29
LogP ≤ 5	21.54
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide?

The IUPAC name of 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide (CID 162214401) is 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide.

What is the SMILES notation for 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide?

The canonical SMILES for 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide is CC(C)N(C)c1nc2cc(C(=O)O)cnc2nc1-c1ccc(F)cc1.CC(C)N(C)c1nc2nc(C(=O)O)ccc2nc1C1CCCC1.CC1CCCN1c1nc2cc(-c3nn[nH]n3)cnc2nc1-c1ccc(F)cc1.CN(c1ccccc1)c1nc2cc(C(=O)O)c(C(F)(F)F)nc2nc1-c1ccc(F)cc1.COc1nc2nc(-c3ccc(F)cc3)c(N(C)c3cccnc3)nc2cc1C(=O)O.NC(=O)c1cnc2nc(-c3ccc(F)cc3)c(N3CCCCC3)nc2c1.

What is the InChIKey of 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide?

The InChIKey is ZTGTUHRPEMYMFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F4N4O2.C21H16FN5O3.C19H17FN8.C19H18FN5O.C18H17FN4O2.C17H22N4O2/c1-30(14-5-3-2-4-6-14)20-17(12-7-9-13(23)10-8-12)28-19-16(27-20)11-15(21(31)32)18(29-19)22(24,25)26;1-27(14-4-3-9-23-11-14)19-17(12-5-7-13(22)8-6-12)25-18-16(24-19)10-15(21(28)29)20(26-18)30-2;1-11-3-2-8-28(11)19-16(12-4-6-14(20)7-5-12)23-18-15(22-19)9-13(10-21-18)17-24-26-27-25-17;20-14-6-4-12(5-7-14)16-19(25-8-2-1-3-9-25)23-15-10-13(17(21)26)11-22-18(15)24-16;1-10(2)23(3)17-15(11-4-6-13(19)7-5-11)22-16-14(21-17)8-12(9-20-16)18(24)25;1-10(2)21(3)16-14(11-6-4-5-7-11)18-12-8-9-13(17(22)23)19-15(12)20-16/h2-11H,1H3,(H,31,32);3-11H,1-2H3,(H,28,29);4-7,9-11H,2-3,8H2,1H3,(H,24,25,26,27);4-7,10-11H,1-3,8-9H2,(H2,21,26);4-10H,1-3H3,(H,24,25);8-11H,4-7H2,1-3H3,(H,22,23).

What are the key properties of 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide?

2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide has a molecular weight of 2230.29 g/mol, XLogP of 21.54, 23 rotatable bonds, 6 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclopentyl-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-(4-fluorophenyl)-6-methoxy-2-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(N-methylanilino)-6-(trifluoromethyl)pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-7-carboxylic acid;3-(4-fluorophenyl)-2-(2-methylpyrrolidin-1-yl)-7-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazine;3-(4-fluorophenyl)-2-piperidin-1-ylpyrido[2,3-b]pyrazine-7-carboxamide is sourced from PubChem (CID 162214401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).