C169H177FN70O15 — CID 159924942
1-[3-(4-aminophenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-(3-aminopyrido[2,3-b]pyrazin-6-yl)-3-ethylurea;1-(3-cyclopentyloxypyrido[2,3-b]pyrazin-6-yl)-3-ethylurea;1-ethyl-3-[3-(4-fluoro-2-hydroxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-hydroxypiperidin-1-yl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-(3-imidazol-1-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-piperazin-1-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-pyridin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-pyrido[2,3-b]pyrazin-6-ylurea;1-ethyl-3-(3-pyrimidin-5-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-(3-phenylpyrido[2,3-b]pyrazin-6-yl)-3-prop-2-enylurea;(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea (PubChem CID 159924942) has the molecular formula C169H177FN70O15 and a molecular weight of 3447.75 g/mol. Its IUPAC name is 1-[3-(4-aminophenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-(3-aminopyrido[2,3-b]pyrazin-6-yl)-3-ethylurea;1-(3-cyclopentyloxypyrido[2,3-b]pyrazin-6-yl)-3-ethylurea;1-ethyl-3-[3-(4-fluoro-2-hydroxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-hydroxypiperidin-1-yl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-(3-imidazol-1-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-piperazin-1-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-pyridin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-pyrido[2,3-b]pyrazin-6-ylurea;1-ethyl-3-(3-pyrimidin-5-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-(3-phenylpyrido[2,3-b]pyrazin-6-yl)-3-prop-2-enylurea;(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea.
| Compound Name | 1-[3-(4-aminophenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-(3-aminopyrido[2,3-b]pyrazin-6-yl)-3-ethylurea;1-(3-cyclopentyloxypyrido[2,3-b]pyrazin-6-yl)-3-ethylurea;1-ethyl-3-[3-(4-fluoro-2-hydroxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-hydroxypiperidin-1-yl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-(3-imidazol-1-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-piperazin-1-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-pyridin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-pyrido[2,3-b]pyrazin-6-ylurea;1-ethyl-3-(3-pyrimidin-5-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-(3-phenylpyrido[2,3-b]pyrazin-6-yl)-3-prop-2-enylurea;(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea |
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| PubChem CID | 159924942 |
| Molecular Formula | C169H177FN70O15 |
| Molecular Weight | 3447.75 g/mol |
| Exact Mass | 3445.52 |
| IUPAC Name | 1-[3-(4-aminophenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-(3-aminopyrido[2,3-b]pyrazin-6-yl)-3-ethylurea;1-(3-cyclopentyloxypyrido[2,3-b]pyrazin-6-yl)-3-ethylurea;1-ethyl-3-[3-(4-fluoro-2-hydroxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-hydroxypiperidin-1-yl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-(3-imidazol-1-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-piperazin-1-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-pyridin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-pyrido[2,3-b]pyrazin-6-ylurea;1-ethyl-3-(3-pyrimidin-5-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-(3-phenylpyrido[2,3-b]pyrazin-6-yl)-3-prop-2-enylurea;(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea |
| SMILES | C=CCNC(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3ccc(F)cc3O)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3ccc(N)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3cccnc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3cncnc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-n3ccnc3)nc2n1.CCNC(=O)Nc1ccc2ncc(N)nc2n1.CCNC(=O)Nc1ccc2ncc(N3CCC(O)CC3)nc2n1.CCNC(=O)Nc1ccc2ncc(N3CCNCC3)nc2n1.CCNC(=O)Nc1ccc2ncc(OC3CCCC3)nc2n1.CCNC(=O)Nc1ccc2nccnc2n1.NC(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1 |
| InChI | InChI=1S/C17H15N5O.C16H14FN5O2.C16H16N6O.C15H20N6O2.C15H14N6O.C15H19N5O2.C14H13N7O.C14H19N7O.C14H11N5O.C13H13N7O.C10H12N6O.C10H11N5O/c1-2-10-18-17(23)22-15-9-8-13-16(21-15)20-14(11-19-13)12-6-4-3-5-7-12;1-2-18-16(24)22-14-6-5-11-15(21-14)20-12(8-19-11)10-4-3-9(17)7-13(10)23;1-2-18-16(23)22-14-8-7-12-15(21-14)20-13(9-19-12)10-3-5-11(17)6-4-10;1-2-16-15(23)19-12-4-3-11-14(18-12)20-13(9-17-11)21-7-5-10(22)6-8-21;1-2-17-15(22)21-13-6-5-11-14(20-13)19-12(9-18-11)10-4-3-7-16-8-10;1-2-16-15(21)19-12-8-7-11-14(18-12)20-13(9-17-11)22-10-5-3-4-6-10;1-2-17-14(22)21-12-4-3-10-13(20-12)19-11(7-18-10)9-5-15-8-16-6-9;1-2-16-14(22)19-11-4-3-10-13(18-11)20-12(9-17-10)21-7-5-15-6-8-21;15-14(20)19-12-7-6-10-13(18-12)17-11(8-16-10)9-4-2-1-3-5-9;1-2-15-13(21)18-10-4-3-9-12(17-10)19-11(7-16-9)20-6-5-14-8-20;1-2-12-10(17)16-8-4-3-6-9(15-8)14-7(11)5-13-6;1-2-11-10(16)15-8-4-3-7-9(14-8)13-6-5-12-7/h2-9,11H,1,10H2,(H2,18,20,21,22,23);3-8,23H,2H2,1H3,(H2,18,20,21,22,24);3-9H,2,17H2,1H3,(H2,18,20,21,22,23);3-4,9-10,22H,2,5-8H2,1H3,(H2,16,18,19,20,23);3-9H,2H2,1H3,(H2,17,19,20,21,22);7-10H,2-6H2,1H3,(H2,16,18,19,20,21);3-8H,2H2,1H3,(H2,17,19,20,21,22);3-4,9,15H,2,5-8H2,1H3,(H2,16,18,19,20,22);1-8H,(H3,15,17,18,19,20);3-8H,2H2,1H3,(H2,15,17,18,19,21);3-5H,2H2,1H3,(H4,11,12,14,15,16,17);3-6H,2H2,1H3,(H2,11,13,14,15,16) |
| InChIKey | NYWVBNQRRXXGRV-UHFFFAOYSA-N |
| XLogP | 21.58 |
| TPSA | 1148.32 Ų |
| H-Bond Donors | 29 |
| H-Bond Acceptors | 61 |
| Rotatable Bonds | 35 |
| Heavy Atoms | 255 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3447.75 |
| LogP ≤ 5 | 21.58 |
| H-Bond Donors ≤ 5 | 29 |
| H-Bond Acceptors ≤ 10 | 61 |
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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