2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane

C87H99BrF4N18O12 — CID 157189697

About 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane

2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane (PubChem CID 157189697) has the molecular formula C87H99BrF4N18O12 and a molecular weight of 1744.76 g/mol. Its IUPAC name is 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane.

Molecular Properties

• Compound Name: 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane
• PubChem CID: 157189697
• Molecular Formula: C87H99BrF4N18O12
• Molecular Weight: 1744.76 g/mol
• Exact Mass: 1742.68
• IUPAC Name: 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane
• SMILES: C.C#CC(=O)OC(C)(C)C.CC(C)(C)OC(=O)c1cn(Cc2nc3ccc(C4CC4)cn3c2F)nn1.CCOC(=O)C(=O)CBr.CCOC(=O)c1cn2cc(C3CC3)ccc2n1.CCOC(=O)c1nc2ccc(C3CC3)cn2c1F.Nc1ccc(C2CC2)cn1.OCc1nc2ccc(C3CC3)cn2c1F.[N-]=[N+]=NCc1nc2ccc(C3CC3)cn2c1F
• InChI: InChI=1S/C18H20FN5O2.C13H13FN2O2.C13H14N2O2.C11H10FN5.C11H11FN2O.C8H10N2.C7H10O2.C5H7BrO3.CH4/c1-18(2,3)26-17(25)14-10-23(22-21-14)9-13-16(19)24-8-12(11-4-5-11)6-7-15(24)20-13;1-2-18-13(17)11-12(14)16-7-9(8-3-4-8)5-6-10(16)15-11;1-2-17-13(16)11-8-15-7-10(9-3-4-9)5-6-12(15)14-11;12-11-9(5-14-16-13)15-10-4-3-8(6-17(10)11)7-1-2-7;12-11-9(6-15)13-10-4-3-8(5-14(10)11)7-1-2-7;9-8-4-3-7(5-10-8)6-1-2-6;1-5-6(8)9-7(2,3)4;1-2-9-5(8)4(7)3-6;/h6-8,10-11H,4-5,9H2,1-3H3;5-8H,2-4H2,1H3;5-9H,2-4H2,1H3;3-4,6-7H,1-2,5H2;3-5,7,15H,1-2,6H2;3-6H,1-2H2,(H2,9,10);1H,2-4H3;2-3H2,1H3;1H4
• InChIKey: APNZZJZBJJXXSV-UHFFFAOYSA-N
• XLogP: 16.52
• TPSA: 373.68 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 28
• Rotatable Bonds: 19
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1744.76
LogP ≤ 5	16.52
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	28

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-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane?

The IUPAC name of 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane (CID 157189697) is 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane.

What is the SMILES notation for 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane?

The canonical SMILES for 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane is C.C#CC(=O)OC(C)(C)C.CC(C)(C)OC(=O)c1cn(Cc2nc3ccc(C4CC4)cn3c2F)nn1.CCOC(=O)C(=O)CBr.CCOC(=O)c1cn2cc(C3CC3)ccc2n1.CCOC(=O)c1nc2ccc(C3CC3)cn2c1F.Nc1ccc(C2CC2)cn1.OCc1nc2ccc(C3CC3)cn2c1F.[N-]=[N+]=NCc1nc2ccc(C3CC3)cn2c1F.

What is the InChIKey of 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane?

The InChIKey is APNZZJZBJJXXSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN5O2.C13H13FN2O2.C13H14N2O2.C11H10FN5.C11H11FN2O.C8H10N2.C7H10O2.C5H7BrO3.CH4/c1-18(2,3)26-17(25)14-10-23(22-21-14)9-13-16(19)24-8-12(11-4-5-11)6-7-15(24)20-13;1-2-18-13(17)11-12(14)16-7-9(8-3-4-8)5-6-10(16)15-11;1-2-17-13(16)11-8-15-7-10(9-3-4-9)5-6-12(15)14-11;12-11-9(5-14-16-13)15-10-4-3-8(6-17(10)11)7-1-2-7;12-11-9(6-15)13-10-4-3-8(5-14(10)11)7-1-2-7;9-8-4-3-7(5-10-8)6-1-2-6;1-5-6(8)9-7(2,3)4;1-2-9-5(8)4(7)3-6;/h6-8,10-11H,4-5,9H2,1-3H3;5-8H,2-4H2,1H3;5-9H,2-4H2,1H3;3-4,6-7H,1-2,5H2;3-5,7,15H,1-2,6H2;3-6H,1-2H2,(H2,9,10);1H,2-4H3;2-3H2,1H3;1H4.

What are the key properties of 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane?

2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane has a molecular weight of 1744.76 g/mol, XLogP of 16.52, 19 rotatable bonds, 2 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(azidomethyl)-6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine;tert-butyl 1-[(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl prop-2-ynoate;(6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridin-2-yl)methanol;5-cyclopropylpyridin-2-amine;ethyl 3-bromo-2-oxopropanoate;ethyl 6-cyclopropyl-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate;ethyl 6-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate;methane is sourced from PubChem (CID 157189697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).