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

C172H112F12N44O6S6 — CID 158708247

IUPAC4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine
SMILESCNc1ccc(C#Cc2nc3ccc(F)nc3o2)cc1.CNc1ccc(C#Cc2nc3ccc(F)nc3o2)cn1.CNc1ccc(C#Cc2nc3ccc(F)nc3o2)nc1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)cc1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)cn1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)nc1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)cc1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)cn1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)nc1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)cc1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)cn1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)nc1
InChIInChI=1S/2C15H10FN3O.2C15H10FN3S.4C14H9FN4O.4C14H9FN4S/c1-17-11-5-2-10(3-6-11)4-9-14-18-12-7-8-13(16)19-15(12)20-14;1-17-11-5-2-10(3-6-11)4-7-15-19-12-9-18-14(16)8-13(12)20-15;1-17-11-5-2-10(3-6-11)4-9-14-18-12-7-8-13(16)19-15(12)20-14;1-17-11-5-2-10(3-6-11)4-7-15-19-12-9-18-14(16)8-13(12)20-15;1-16-12-6-2-9(8-17-12)3-7-13-18-10-4-5-11(15)19-14(10)20-13;1-16-13-4-2-9(7-18-13)3-5-14-19-10-8-17-12(15)6-11(10)20-14;1-16-10-3-2-9(17-8-10)4-7-13-18-11-5-6-12(15)19-14(11)20-13;1-16-10-3-2-9(17-7-10)4-5-14-19-11-8-18-13(15)6-12(11)20-14;1-16-12-6-2-9(8-17-12)3-7-13-18-10-4-5-11(15)19-14(10)20-13;1-16-13-4-2-9(7-18-13)3-5-14-19-10-8-17-12(15)6-11(10)20-14;1-16-10-3-2-9(17-8-10)4-7-13-18-11-5-6-12(15)19-14(11)20-13;1-16-10-3-2-9(17-7-10)4-5-14-19-11-8-18-13(15)6-12(11)20-14/h2-3,5-8,17H,1H3;2-3,5-6,8-9,17H,1H3;2-3,5-8,17H,1H3;2-3,5-6,8-9,17H,1H3;2,4-6,8H,1H3,(H,16,17);2,4,6-8H,1H3,(H,16,18);2-3,5-6,8,16H,1H3;2-3,6-8,16H,1H3;2,4-6,8H,1H3,(H,16,17);2,4,6-8H,1H3,(H,16,18);2-3,5-6,8,16H,1H3;2-3,6-8,16H,1H3
InChIKeyIIJXCNGHEVCFKX-UHFFFAOYSA-N
MW3311.47 g/mol
LogP31.61
Rot. Bonds12

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

4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine (PubChem CID 158708247) has the molecular formula C172H112F12N44O6S6 and a molecular weight of 3311.47 g/mol. Its IUPAC name is 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine.

Molecular Properties

Compound Name4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine
PubChem CID158708247
Molecular FormulaC172H112F12N44O6S6
Molecular Weight3311.47 g/mol
Exact Mass3308.79
IUPAC Name4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine
SMILESCNc1ccc(C#Cc2nc3ccc(F)nc3o2)cc1.CNc1ccc(C#Cc2nc3ccc(F)nc3o2)cn1.CNc1ccc(C#Cc2nc3ccc(F)nc3o2)nc1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)cc1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)cn1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)nc1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)cc1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)cn1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)nc1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)cc1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)cn1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)nc1
InChIInChI=1S/2C15H10FN3O.2C15H10FN3S.4C14H9FN4O.4C14H9FN4S/c1-17-11-5-2-10(3-6-11)4-9-14-18-12-7-8-13(16)19-15(12)20-14;1-17-11-5-2-10(3-6-11)4-7-15-19-12-9-18-14(16)8-13(12)20-15;1-17-11-5-2-10(3-6-11)4-9-14-18-12-7-8-13(16)19-15(12)20-14;1-17-11-5-2-10(3-6-11)4-7-15-19-12-9-18-14(16)8-13(12)20-15;1-16-12-6-2-9(8-17-12)3-7-13-18-10-4-5-11(15)19-14(10)20-13;1-16-13-4-2-9(7-18-13)3-5-14-19-10-8-17-12(15)6-11(10)20-14;1-16-10-3-2-9(17-8-10)4-7-13-18-11-5-6-12(15)19-14(11)20-13;1-16-10-3-2-9(17-7-10)4-5-14-19-11-8-18-13(15)6-12(11)20-14;1-16-12-6-2-9(8-17-12)3-7-13-18-10-4-5-11(15)19-14(10)20-13;1-16-13-4-2-9(7-18-13)3-5-14-19-10-8-17-12(15)6-11(10)20-14;1-16-10-3-2-9(17-8-10)4-7-13-18-11-5-6-12(15)19-14(11)20-13;1-16-10-3-2-9(17-7-10)4-5-14-19-11-8-18-13(15)6-12(11)20-14/h2-3,5-8,17H,1H3;2-3,5-6,8-9,17H,1H3;2-3,5-8,17H,1H3;2-3,5-6,8-9,17H,1H3;2,4-6,8H,1H3,(H,16,17);2,4,6-8H,1H3,(H,16,18);2-3,5-6,8,16H,1H3;2-3,6-8,16H,1H3;2,4-6,8H,1H3,(H,16,17);2,4,6-8H,1H3,(H,16,18);2-3,5-6,8,16H,1H3;2-3,6-8,16H,1H3
InChIKeyIIJXCNGHEVCFKX-UHFFFAOYSA-N
XLogP31.61
TPSA635.68 Ų
H-Bond Donors12
H-Bond Acceptors56
Rotatable Bonds12
Heavy Atoms240
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003311.47
LogP ≤ 531.61
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1056

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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

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Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine?
The IUPAC name of 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine (CID 158708247) is 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine.
What is the SMILES notation for 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine?
The canonical SMILES for 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine is CNc1ccc(C#Cc2nc3ccc(F)nc3o2)cc1.CNc1ccc(C#Cc2nc3ccc(F)nc3o2)cn1.CNc1ccc(C#Cc2nc3ccc(F)nc3o2)nc1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)cc1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)cn1.CNc1ccc(C#Cc2nc3ccc(F)nc3s2)nc1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)cc1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)cn1.CNc1ccc(C#Cc2nc3cnc(F)cc3o2)nc1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)cc1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)cn1.CNc1ccc(C#Cc2nc3cnc(F)cc3s2)nc1.
What is the InChIKey of 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine?
The InChIKey is IIJXCNGHEVCFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H10FN3O.2C15H10FN3S.4C14H9FN4O.4C14H9FN4S/c1-17-11-5-2-10(3-6-11)4-9-14-18-12-7-8-13(16)19-15(12)20-14;1-17-11-5-2-10(3-6-11)4-7-15-19-12-9-18-14(16)8-13(12)20-15;1-17-11-5-2-10(3-6-11)4-9-14-18-12-7-8-13(16)19-15(12)20-14;1-17-11-5-2-10(3-6-11)4-7-15-19-12-9-18-14(16)8-13(12)20-15;1-16-12-6-2-9(8-17-12)3-7-13-18-10-4-5-11(15)19-14(10)20-13;1-16-13-4-2-9(7-18-13)3-5-14-19-10-8-17-12(15)6-11(10)20-14;1-16-10-3-2-9(17-8-10)4-7-13-18-11-5-6-12(15)19-14(11)20-13;1-16-10-3-2-9(17-7-10)4-5-14-19-11-8-18-13(15)6-12(11)20-14;1-16-12-6-2-9(8-17-12)3-7-13-18-10-4-5-11(15)19-14(10)20-13;1-16-13-4-2-9(7-18-13)3-5-14-19-10-8-17-12(15)6-11(10)20-14;1-16-10-3-2-9(17-8-10)4-7-13-18-11-5-6-12(15)19-14(11)20-13;1-16-10-3-2-9(17-7-10)4-5-14-19-11-8-18-13(15)6-12(11)20-14/h2-3,5-8,17H,1H3;2-3,5-6,8-9,17H,1H3;2-3,5-8,17H,1H3;2-3,5-6,8-9,17H,1H3;2,4-6,8H,1H3,(H,16,17);2,4,6-8H,1H3,(H,16,18);2-3,5-6,8,16H,1H3;2-3,6-8,16H,1H3;2,4-6,8H,1H3,(H,16,17);2,4,6-8H,1H3,(H,16,18);2-3,5-6,8,16H,1H3;2-3,6-8,16H,1H3.
What are the key properties of 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine?
4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine has a molecular weight of 3311.47 g/mol, XLogP of 31.61, 12 rotatable bonds, 12 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]oxazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(5-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine;4-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylaniline;5-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-2-amine;6-[2-(6-fluoro-[1,3]thiazolo[4,5-c]pyridin-2-yl)ethynyl]-N-methylpyridin-3-amine is sourced from PubChem (CID 158708247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).