3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane

C153H209BrCl3F3N38O19 — CID 159845775

IUPAC3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane
SMILESC#CC(=O)OC(C)(C)C.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cn3cc(CCl)nc23)CC1.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cn3cc(CN=[N+]=[N-])nc23)CC1.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cnc2N)CC1.CC(C)(C)OC(=O)N1CCNCC1.CC(C)(C)OC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCN(C(=O)OC(C)(C)C)CC4)c3n2)nn1.CCC(F)(F)F.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCCCC4)c3n2)nn1.Nc1ncc(C2CC2)cc1Br.O=C(CCl)CCl.O=C(O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCCCC4)c3n2)nn1
InChIInChI=1S/C27H37N7O4.C20H27ClN4O2.C20H27N7O2.C20H24N6O2.C19H22N6O2.C17H26N4O2.C9H18N2O2.C8H9BrN2.C7H10O2.C3H4Cl2O.C3H5F3/c1-26(2,3)37-24(35)21-17-34(30-29-21)16-20-15-33-14-19(18-7-8-18)13-22(23(33)28-20)31-9-11-32(12-10-31)25(36)38-27(4,5)6;1-20(2,3)27-19(26)24-8-6-23(7-9-24)17-10-15(14-4-5-14)12-25-13-16(11-21)22-18(17)25;1-20(2,3)29-19(28)26-8-6-25(7-9-26)17-10-15(14-4-5-14)12-27-13-16(11-22-24-21)23-18(17)27;1-28-20(27)17-13-26(23-22-17)12-16-11-25-10-15(14-5-6-14)9-18(19(25)21-16)24-7-3-2-4-8-24;26-19(27)16-12-25(22-21-16)11-15-10-24-9-14(13-4-5-13)8-17(18(24)20-15)23-6-2-1-3-7-23;1-17(2,3)23-16(22)21-8-6-20(7-9-21)14-10-13(12-4-5-12)11-19-15(14)18;1-9(2,3)13-8(12)11-6-4-10-5-7-11;9-7-3-6(5-1-2-5)4-11-8(7)10;1-5-6(8)9-7(2,3)4;4-1-3(6)2-5;1-2-3(4,5)6/h13-15,17-18H,7-12,16H2,1-6H3;10,12-14H,4-9,11H2,1-3H3;10,12-14H,4-9,11H2,1-3H3;9-11,13-14H,2-8,12H2,1H3;8-10,12-13H,1-7,11H2,(H,26,27);10-12H,4-9H2,1-3H3,(H2,18,19);10H,4-7H2,1-3H3;3-5H,1-2H2,(H2,10,11);1H,2-4H3;1-2H2;2H2,1H3
InChIKeyNPGXLBNSPPVPMD-UHFFFAOYSA-N
MW3127.86 g/mol
LogP26.80
Rot. Bonds27

About 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane

3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane (PubChem CID 159845775) has the molecular formula C153H209BrCl3F3N38O19 and a molecular weight of 3127.86 g/mol. Its IUPAC name is 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane.

Molecular Properties

Compound Name3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane
PubChem CID159845775
Molecular FormulaC153H209BrCl3F3N38O19
Molecular Weight3127.86 g/mol
Exact Mass3123.48
IUPAC Name3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane
SMILESC#CC(=O)OC(C)(C)C.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cn3cc(CCl)nc23)CC1.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cn3cc(CN=[N+]=[N-])nc23)CC1.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cnc2N)CC1.CC(C)(C)OC(=O)N1CCNCC1.CC(C)(C)OC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCN(C(=O)OC(C)(C)C)CC4)c3n2)nn1.CCC(F)(F)F.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCCCC4)c3n2)nn1.Nc1ncc(C2CC2)cc1Br.O=C(CCl)CCl.O=C(O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCCCC4)c3n2)nn1
InChIInChI=1S/C27H37N7O4.C20H27ClN4O2.C20H27N7O2.C20H24N6O2.C19H22N6O2.C17H26N4O2.C9H18N2O2.C8H9BrN2.C7H10O2.C3H4Cl2O.C3H5F3/c1-26(2,3)37-24(35)21-17-34(30-29-21)16-20-15-33-14-19(18-7-8-18)13-22(23(33)28-20)31-9-11-32(12-10-31)25(36)38-27(4,5)6;1-20(2,3)27-19(26)24-8-6-23(7-9-24)17-10-15(14-4-5-14)12-25-13-16(11-21)22-18(17)25;1-20(2,3)29-19(28)26-8-6-25(7-9-26)17-10-15(14-4-5-14)12-27-13-16(11-22-24-21)23-18(17)27;1-28-20(27)17-13-26(23-22-17)12-16-11-25-10-15(14-5-6-14)9-18(19(25)21-16)24-7-3-2-4-8-24;26-19(27)16-12-25(22-21-16)11-15-10-24-9-14(13-4-5-13)8-17(18(24)20-15)23-6-2-1-3-7-23;1-17(2,3)23-16(22)21-8-6-20(7-9-21)14-10-13(12-4-5-12)11-19-15(14)18;1-9(2,3)13-8(12)11-6-4-10-5-7-11;9-7-3-6(5-1-2-5)4-11-8(7)10;1-5-6(8)9-7(2,3)4;4-1-3(6)2-5;1-2-3(4,5)6/h13-15,17-18H,7-12,16H2,1-6H3;10,12-14H,4-9,11H2,1-3H3;10,12-14H,4-9,11H2,1-3H3;9-11,13-14H,2-8,12H2,1H3;8-10,12-13H,1-7,11H2,(H,26,27);10-12H,4-9H2,1-3H3,(H2,18,19);10H,4-7H2,1-3H3;3-5H,1-2H2,(H2,10,11);1H,2-4H3;1-2H2;2H2,1H3
InChIKeyNPGXLBNSPPVPMD-UHFFFAOYSA-N
XLogP26.80
TPSA617.65 Ų
H-Bond Donors4
H-Bond Acceptors49
Rotatable Bonds27
Heavy Atoms217
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003127.86
LogP ≤ 526.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1049

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane?
The IUPAC name of 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane (CID 159845775) is 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane.
What is the SMILES notation for 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane?
The canonical SMILES for 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane is C#CC(=O)OC(C)(C)C.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cn3cc(CCl)nc23)CC1.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cn3cc(CN=[N+]=[N-])nc23)CC1.CC(C)(C)OC(=O)N1CCN(c2cc(C3CC3)cnc2N)CC1.CC(C)(C)OC(=O)N1CCNCC1.CC(C)(C)OC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCN(C(=O)OC(C)(C)C)CC4)c3n2)nn1.CCC(F)(F)F.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCCCC4)c3n2)nn1.Nc1ncc(C2CC2)cc1Br.O=C(CCl)CCl.O=C(O)c1cn(Cc2cn3cc(C4CC4)cc(N4CCCCC4)c3n2)nn1.
What is the InChIKey of 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane?
The InChIKey is NPGXLBNSPPVPMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H37N7O4.C20H27ClN4O2.C20H27N7O2.C20H24N6O2.C19H22N6O2.C17H26N4O2.C9H18N2O2.C8H9BrN2.C7H10O2.C3H4Cl2O.C3H5F3/c1-26(2,3)37-24(35)21-17-34(30-29-21)16-20-15-33-14-19(18-7-8-18)13-22(23(33)28-20)31-9-11-32(12-10-31)25(36)38-27(4,5)6;1-20(2,3)27-19(26)24-8-6-23(7-9-24)17-10-15(14-4-5-14)12-25-13-16(11-21)22-18(17)25;1-20(2,3)29-19(28)26-8-6-25(7-9-26)17-10-15(14-4-5-14)12-27-13-16(11-22-24-21)23-18(17)27;1-28-20(27)17-13-26(23-22-17)12-16-11-25-10-15(14-5-6-14)9-18(19(25)21-16)24-7-3-2-4-8-24;26-19(27)16-12-25(22-21-16)11-15-10-24-9-14(13-4-5-13)8-17(18(24)20-15)23-6-2-1-3-7-23;1-17(2,3)23-16(22)21-8-6-20(7-9-21)14-10-13(12-4-5-12)11-19-15(14)18;1-9(2,3)13-8(12)11-6-4-10-5-7-11;9-7-3-6(5-1-2-5)4-11-8(7)10;1-5-6(8)9-7(2,3)4;4-1-3(6)2-5;1-2-3(4,5)6/h13-15,17-18H,7-12,16H2,1-6H3;10,12-14H,4-9,11H2,1-3H3;10,12-14H,4-9,11H2,1-3H3;9-11,13-14H,2-8,12H2,1H3;8-10,12-13H,1-7,11H2,(H,26,27);10-12H,4-9H2,1-3H3,(H2,18,19);10H,4-7H2,1-3H3;3-5H,1-2H2,(H2,10,11);1H,2-4H3;1-2H2;2H2,1H3.
What are the key properties of 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane?
3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane has a molecular weight of 3127.86 g/mol, XLogP of 26.80, 27 rotatable bonds, 4 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-cyclopropylpyridin-2-amine;tert-butyl 4-(2-amino-5-cyclopropyl-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl 4-[6-cyclopropyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-8-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;tert-butyl prop-2-ynoate;1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid;1,3-dichloropropan-2-one;methyl 1-[(6-cyclopropyl-8-piperidin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;1,1,1-trifluoropropane is sourced from PubChem (CID 159845775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).