4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline

C187H129F6N47O6S7 — CID 158276311

IUPAC4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline
SMILESCNc1ccc(C#Cc2nc3cccnc3o2)cc1.CNc1ccc(C#Cc2nc3cccnc3o2)cn1.CNc1ccc(C#Cc2nc3cccnc3o2)nc1.CNc1ccc(C#Cc2nc3cccnc3s2)cc1.CNc1ccc(C#Cc2nc3cccnc3s2)cn1.CNc1ccc(C#Cc2nc3cccnc3s2)nc1.CNc1ccc(C#Cc2nc3cnccc3s2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)cn1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)nc1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)cn1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)nc1
InChIInChI=1S/C15H10FN3O.C15H10FN3S.C15H11N3O.2C15H11N3S.2C14H9FN4O.2C14H9FN4S.2C14H10N4O.2C14H10N4S/c2*1-17-11-5-2-10(3-6-11)4-7-13-19-15-14(20-13)12(16)8-9-18-15;1-16-12-7-4-11(5-8-12)6-9-14-18-13-3-2-10-17-15(13)19-14;1-16-12-5-2-11(3-6-12)4-7-15-18-13-10-17-9-8-14(13)19-15;1-16-12-7-4-11(5-8-12)6-9-14-18-13-3-2-10-17-15(13)19-14;1-16-11-4-2-9(8-18-11)3-5-12-19-14-13(20-12)10(15)6-7-17-14;1-16-10-3-2-9(18-8-10)4-5-12-19-14-13(20-12)11(15)6-7-17-14;1-16-11-4-2-9(8-18-11)3-5-12-19-14-13(20-12)10(15)6-7-17-14;1-16-10-3-2-9(18-8-10)4-5-12-19-14-13(20-12)11(15)6-7-17-14;1-15-12-6-4-10(9-17-12)5-7-13-18-11-3-2-8-16-14(11)19-13;1-15-11-5-4-10(17-9-11)6-7-13-18-12-3-2-8-16-14(12)19-13;1-15-12-6-4-10(9-17-12)5-7-13-18-11-3-2-8-16-14(11)19-13;1-15-11-5-4-10(17-9-11)6-7-13-18-12-3-2-8-16-14(12)19-13/h2*2-3,5-6,8-9,17H,1H3;2-5,7-8,10,16H,1H3;2-3,5-6,8-10,16H,1H3;2-5,7-8,10,16H,1H3;2,4,6-8H,1H3,(H,16,18);2-3,6-8,16H,1H3;2,4,6-8H,1H3,(H,16,18);2-3,6-8,16H,1H3;2-4,6,8-9H,1H3,(H,15,17);2-5,8-9,15H,1H3;2-4,6,8-9H,1H3,(H,15,17);2-5,8-9,15H,1H3
InChIKeyGJQMRNOQXUMPJW-UHFFFAOYSA-N
MW3468.87 g/mol
LogP33.91
Rot. Bonds13

About 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline

4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline (PubChem CID 158276311) has the molecular formula C187H129F6N47O6S7 and a molecular weight of 3468.87 g/mol. Its IUPAC name is 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline.

Molecular Properties

Compound Name4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline
PubChem CID158276311
Molecular FormulaC187H129F6N47O6S7
Molecular Weight3468.87 g/mol
Exact Mass3465.92
IUPAC Name4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline
SMILESCNc1ccc(C#Cc2nc3cccnc3o2)cc1.CNc1ccc(C#Cc2nc3cccnc3o2)cn1.CNc1ccc(C#Cc2nc3cccnc3o2)nc1.CNc1ccc(C#Cc2nc3cccnc3s2)cc1.CNc1ccc(C#Cc2nc3cccnc3s2)cn1.CNc1ccc(C#Cc2nc3cccnc3s2)nc1.CNc1ccc(C#Cc2nc3cnccc3s2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)cn1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)nc1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)cn1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)nc1
InChIInChI=1S/C15H10FN3O.C15H10FN3S.C15H11N3O.2C15H11N3S.2C14H9FN4O.2C14H9FN4S.2C14H10N4O.2C14H10N4S/c2*1-17-11-5-2-10(3-6-11)4-7-13-19-15-14(20-13)12(16)8-9-18-15;1-16-12-7-4-11(5-8-12)6-9-14-18-13-3-2-10-17-15(13)19-14;1-16-12-5-2-11(3-6-12)4-7-15-18-13-10-17-9-8-14(13)19-15;1-16-12-7-4-11(5-8-12)6-9-14-18-13-3-2-10-17-15(13)19-14;1-16-11-4-2-9(8-18-11)3-5-12-19-14-13(20-12)10(15)6-7-17-14;1-16-10-3-2-9(18-8-10)4-5-12-19-14-13(20-12)11(15)6-7-17-14;1-16-11-4-2-9(8-18-11)3-5-12-19-14-13(20-12)10(15)6-7-17-14;1-16-10-3-2-9(18-8-10)4-5-12-19-14-13(20-12)11(15)6-7-17-14;1-15-12-6-4-10(9-17-12)5-7-13-18-11-3-2-8-16-14(11)19-13;1-15-11-5-4-10(17-9-11)6-7-13-18-12-3-2-8-16-14(12)19-13;1-15-12-6-4-10(9-17-12)5-7-13-18-11-3-2-8-16-14(11)19-13;1-15-11-5-4-10(17-9-11)6-7-13-18-12-3-2-8-16-14(12)19-13/h2*2-3,5-6,8-9,17H,1H3;2-5,7-8,10,16H,1H3;2-3,5-6,8-10,16H,1H3;2-5,7-8,10,16H,1H3;2,4,6-8H,1H3,(H,16,18);2-3,6-8,16H,1H3;2,4,6-8H,1H3,(H,16,18);2-3,6-8,16H,1H3;2-4,6,8-9H,1H3,(H,15,17);2-5,8-9,15H,1H3;2-4,6,8-9H,1H3,(H,15,17);2-5,8-9,15H,1H3
InChIKeyGJQMRNOQXUMPJW-UHFFFAOYSA-N
XLogP33.91
TPSA673.49 Ų
H-Bond Donors13
H-Bond Acceptors60
Rotatable Bonds13
Heavy Atoms253
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003468.87
LogP ≤ 533.91
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1060

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline?
The IUPAC name of 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline (CID 158276311) is 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline.
What is the SMILES notation for 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline?
The canonical SMILES for 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline is CNc1ccc(C#Cc2nc3cccnc3o2)cc1.CNc1ccc(C#Cc2nc3cccnc3o2)cn1.CNc1ccc(C#Cc2nc3cccnc3o2)nc1.CNc1ccc(C#Cc2nc3cccnc3s2)cc1.CNc1ccc(C#Cc2nc3cccnc3s2)cn1.CNc1ccc(C#Cc2nc3cccnc3s2)nc1.CNc1ccc(C#Cc2nc3cnccc3s2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)cn1.CNc1ccc(C#Cc2nc3nccc(F)c3o2)nc1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)cc1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)cn1.CNc1ccc(C#Cc2nc3nccc(F)c3s2)nc1.
What is the InChIKey of 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline?
The InChIKey is GJQMRNOQXUMPJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3O.C15H10FN3S.C15H11N3O.2C15H11N3S.2C14H9FN4O.2C14H9FN4S.2C14H10N4O.2C14H10N4S/c2*1-17-11-5-2-10(3-6-11)4-7-13-19-15-14(20-13)12(16)8-9-18-15;1-16-12-7-4-11(5-8-12)6-9-14-18-13-3-2-10-17-15(13)19-14;1-16-12-5-2-11(3-6-12)4-7-15-18-13-10-17-9-8-14(13)19-15;1-16-12-7-4-11(5-8-12)6-9-14-18-13-3-2-10-17-15(13)19-14;1-16-11-4-2-9(8-18-11)3-5-12-19-14-13(20-12)10(15)6-7-17-14;1-16-10-3-2-9(18-8-10)4-5-12-19-14-13(20-12)11(15)6-7-17-14;1-16-11-4-2-9(8-18-11)3-5-12-19-14-13(20-12)10(15)6-7-17-14;1-16-10-3-2-9(18-8-10)4-5-12-19-14-13(20-12)11(15)6-7-17-14;1-15-12-6-4-10(9-17-12)5-7-13-18-11-3-2-8-16-14(11)19-13;1-15-11-5-4-10(17-9-11)6-7-13-18-12-3-2-8-16-14(12)19-13;1-15-12-6-4-10(9-17-12)5-7-13-18-11-3-2-8-16-14(11)19-13;1-15-11-5-4-10(17-9-11)6-7-13-18-12-3-2-8-16-14(12)19-13/h2*2-3,5-6,8-9,17H,1H3;2-5,7-8,10,16H,1H3;2-3,5-6,8-10,16H,1H3;2-5,7-8,10,16H,1H3;2,4,6-8H,1H3,(H,16,18);2-3,6-8,16H,1H3;2,4,6-8H,1H3,(H,16,18);2-3,6-8,16H,1H3;2-4,6,8-9H,1H3,(H,15,17);2-5,8-9,15H,1H3;2-4,6,8-9H,1H3,(H,15,17);2-5,8-9,15H,1H3.
What are the key properties of 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline?
4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline has a molecular weight of 3468.87 g/mol, XLogP of 33.91, 13 rotatable bonds, 13 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(7-fluoro-[1,3]thiazolo[4,5-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;N-methyl-4-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]aniline;N-methyl-5-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-2-amine;N-methyl-6-[2-([1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]pyridin-3-amine;N-methyl-4-[2-([1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]aniline is sourced from PubChem (CID 158276311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).