2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one

C129H159BBrCl8N21O27 — CID 157347789

About 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one

2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one (PubChem CID 157347789) has the molecular formula C129H159BBrCl8N21O27 and a molecular weight of 2810.15 g/mol. Its IUPAC name is 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one.

Molecular Properties

• Compound Name: 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one
• PubChem CID: 157347789
• Molecular Formula: C129H159BBrCl8N21O27
• Molecular Weight: 2810.15 g/mol
• Exact Mass: 2803.85
• IUPAC Name: 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one
• SMILES: C#CC(=O)OCc1ccccc1.CC(C)(C)OC(=O)C(C)(C)Br.CC(C)(C)OC(=O)C(C)(C)Oc1cc(C2CC2)cn2cc(Cn3cc(C(=O)OCc4ccccc4)nn3)nc12.CC(C)(C)OC(=O)C(C)(C)Oc1cc(Cl)cn2cc(CCl)nc12.CC(C)(C)OC(=O)C(C)(C)Oc1cc(Cl)cn2cc(CN=[N+]=[N-])nc12.CC(C)(C)OC(=O)C(C)(C)Oc1cc(Cl)cn2cc(Cn3cc(C(=O)OCc4ccccc4)nn3)nc12.CC(C)(C)OC(=O)C(C)(C)Oc1cc(Cl)cnc1N.Nc1ncc(Cl)cc1O.O=C(CCl)CCl.OB(O)C1CC1
• InChI: InChI=1S/C29H33N5O5.C26H28ClN5O5.C16H20Cl2N2O3.C16H20ClN5O3.C13H19ClN2O3.C10H8O2.C8H15BrO2.C5H5ClN2O.C3H7BO2.C3H4Cl2O/c1-28(2,3)39-27(36)29(4,5)38-24-13-21(20-11-12-20)14-33-15-22(30-25(24)33)16-34-17-23(31-32-34)26(35)37-18-19-9-7-6-8-10-19;1-25(2,3)37-24(34)26(4,5)36-21-11-18(27)12-31-13-19(28-22(21)31)14-32-15-20(29-30-32)23(33)35-16-17-9-7-6-8-10-17;1-15(2,3)23-14(21)16(4,5)22-12-6-10(18)8-20-9-11(7-17)19-13(12)20;1-15(2,3)25-14(23)16(4,5)24-12-6-10(17)8-22-9-11(7-19-21-18)20-13(12)22;1-12(2,3)19-11(17)13(4,5)18-9-6-8(14)7-16-10(9)15;1-2-10(11)12-8-9-6-4-3-5-7-9;1-7(2,3)11-6(10)8(4,5)9;6-3-1-4(9)5(7)8-2-3;5-4(6)3-1-2-3;4-1-3(6)2-5/h6-10,13-15,17,20H,11-12,16,18H2,1-5H3;6-13,15H,14,16H2,1-5H3;6,8-9H,7H2,1-5H3;6,8-9H,7H2,1-5H3;6-7H,1-5H3,(H2,15,16);1,3-7H,8H2;1-5H3;1-2,9H,(H2,7,8);3,5-6H,1-2H2;1-2H2
• InChIKey: BHEGEZMGBLTYEB-UHFFFAOYSA-N
• XLogP: 26.07
• TPSA: 617.81 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 46
• Rotatable Bonds: 35
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2810.15
LogP ≤ 5	26.07
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	46

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'}

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one?

The IUPAC name of 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one (CID 157347789) is 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one.

What is the SMILES notation for 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one?

The canonical SMILES for 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one is C#CC(=O)OCc1ccccc1.CC(C)(C)OC(=O)C(C)(C)Br.CC(C)(C)OC(=O)C(C)(C)Oc1cc(C2CC2)cn2cc(Cn3cc(C(=O)OCc4ccccc4)nn3)nc12.CC(C)(C)OC(=O)C(C)(C)Oc1cc(Cl)cn2cc(CCl)nc12.CC(C)(C)OC(=O)C(C)(C)Oc1cc(Cl)cn2cc(CN=[N+]=[N-])nc12.CC(C)(C)OC(=O)C(C)(C)Oc1cc(Cl)cn2cc(Cn3cc(C(=O)OCc4ccccc4)nn3)nc12.CC(C)(C)OC(=O)C(C)(C)Oc1cc(Cl)cnc1N.Nc1ncc(Cl)cc1O.O=C(CCl)CCl.OB(O)C1CC1.

What is the InChIKey of 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one?

The InChIKey is BHEGEZMGBLTYEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H33N5O5.C26H28ClN5O5.C16H20Cl2N2O3.C16H20ClN5O3.C13H19ClN2O3.C10H8O2.C8H15BrO2.C5H5ClN2O.C3H7BO2.C3H4Cl2O/c1-28(2,3)39-27(36)29(4,5)38-24-13-21(20-11-12-20)14-33-15-22(30-25(24)33)16-34-17-23(31-32-34)26(35)37-18-19-9-7-6-8-10-19;1-25(2,3)37-24(34)26(4,5)36-21-11-18(27)12-31-13-19(28-22(21)31)14-32-15-20(29-30-32)23(33)35-16-17-9-7-6-8-10-17;1-15(2,3)23-14(21)16(4,5)22-12-6-10(18)8-20-9-11(7-17)19-13(12)20;1-15(2,3)25-14(23)16(4,5)24-12-6-10(17)8-22-9-11(7-19-21-18)20-13(12)22;1-12(2,3)19-11(17)13(4,5)18-9-6-8(14)7-16-10(9)15;1-2-10(11)12-8-9-6-4-3-5-7-9;1-7(2,3)11-6(10)8(4,5)9;6-3-1-4(9)5(7)8-2-3;5-4(6)3-1-2-3;4-1-3(6)2-5/h6-10,13-15,17,20H,11-12,16,18H2,1-5H3;6-13,15H,14,16H2,1-5H3;6,8-9H,7H2,1-5H3;6,8-9H,7H2,1-5H3;6-7H,1-5H3,(H2,15,16);1,3-7H,8H2;1-5H3;1-2,9H,(H2,7,8);3,5-6H,1-2H2;1-2H2.

What are the key properties of 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one?

2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one has a molecular weight of 2810.15 g/mol, XLogP of 26.07, 35 rotatable bonds, 5 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-5-chloropyridin-3-ol;benzyl 1-[[6-chloro-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl 1-[[6-cyclopropyl-8-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyimidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;benzyl prop-2-ynoate;tert-butyl 2-[(2-amino-5-chloro-3-pyridinyl)oxy]-2-methylpropanoate;tert-butyl 2-[2-(azidomethyl)-6-chloroimidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;tert-butyl 2-bromo-2-methylpropanoate;tert-butyl 2-[6-chloro-2-(chloromethyl)imidazo[1,2-a]pyridin-8-yl]oxy-2-methylpropanoate;cyclopropylboronic acid;1,3-dichloropropan-2-one is sourced from PubChem (CID 157347789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).