N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide

C157H111Cl4F4N27O10 — CID 158344943

About N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide

N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide (PubChem CID 158344943) has the molecular formula C157H111Cl4F4N27O10 and a molecular weight of 2753.60 g/mol. Its IUPAC name is N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide.

Molecular Properties

• Compound Name: N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide
• PubChem CID: 158344943
• Molecular Formula: C157H111Cl4F4N27O10
• Molecular Weight: 2753.60 g/mol
• Exact Mass: 2749.77
• IUPAC Name: N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide
• SMILES: C#CC(=O)Nc1cc(-c2cnc3[nH]cc(Cl)c3c2)ccc1F.C#CC(=O)Nc1cc(-c2cnc3[nH]ccc3c2)ccc1F.C#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.C#CC(=O)Nc1cccc(-c2cnc3[nH]ccc3c2)c1.C=CC(=O)Nc1cccc(-c2cnc3[nH]cc(-c4cc(F)cc(F)c4OC)c3c2)c1.CC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.CC#CC(=O)Nc1cccc(-c2cnc3[nH]ccc3c2)c1.CCC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.CCC#CC(=O)Nc1cccc(-c2cnc3[nH]ccc3c2)c1
• InChI: InChI=1S/C23H17F2N3O2.C18H14ClN3O.C18H15N3O.C17H12ClN3O.C17H13N3O.C16H9ClFN3O.C16H10ClN3O.C16H10FN3O.C16H11N3O/c1-3-21(29)28-16-6-4-5-13(7-16)14-8-18-19(12-27-23(18)26-11-14)17-9-15(24)10-20(25)22(17)30-2;1-2-3-7-17(23)22-14-6-4-5-12(8-14)13-9-15-16(19)11-21-18(15)20-10-13;1-2-3-7-17(22)21-16-6-4-5-13(11-16)15-10-14-8-9-19-18(14)20-12-15;1-2-4-16(22)21-13-6-3-5-11(7-13)12-8-14-15(18)10-20-17(14)19-9-12;1-2-4-16(21)20-15-6-3-5-12(10-15)14-9-13-7-8-18-17(13)19-11-14;1-2-15(22)21-14-6-9(3-4-13(14)18)10-5-11-12(17)8-20-16(11)19-7-10;1-2-15(21)20-12-5-3-4-10(6-12)11-7-13-14(17)9-19-16(13)18-8-11;1-2-15(21)20-14-8-10(3-4-13(14)17)12-7-11-5-6-18-16(11)19-9-12;1-2-15(20)19-14-5-3-4-11(9-14)13-8-12-6-7-17-16(12)18-10-13/h3-12H,1H2,2H3,(H,26,27)(H,28,29);4-6,8-11H,2H2,1H3,(H,20,21)(H,22,23);4-6,8-12H,2H2,1H3,(H,19,20)(H,21,22);3,5-10H,1H3,(H,19,20)(H,21,22);3,5-11H,1H3,(H,18,19)(H,20,21);1,3-8H,(H,19,20)(H,21,22);2*1,3-9H,(H,18,19)(H,20,21);1,3-10H,(H,17,18)(H,19,20)
• InChIKey: GRPPNOYMZHKCMQ-UHFFFAOYSA-N
• XLogP: 32.95
• TPSA: 529.25 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 19
• Rotatable Bonds: 21
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2753.60
LogP ≤ 5	32.95
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide?

The IUPAC name of N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide (CID 158344943) is N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide.

What is the SMILES notation for N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide?

The canonical SMILES for N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide is C#CC(=O)Nc1cc(-c2cnc3[nH]cc(Cl)c3c2)ccc1F.C#CC(=O)Nc1cc(-c2cnc3[nH]ccc3c2)ccc1F.C#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.C#CC(=O)Nc1cccc(-c2cnc3[nH]ccc3c2)c1.C=CC(=O)Nc1cccc(-c2cnc3[nH]cc(-c4cc(F)cc(F)c4OC)c3c2)c1.CC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.CC#CC(=O)Nc1cccc(-c2cnc3[nH]ccc3c2)c1.CCC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.CCC#CC(=O)Nc1cccc(-c2cnc3[nH]ccc3c2)c1.

What is the InChIKey of N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide?

The InChIKey is GRPPNOYMZHKCMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17F2N3O2.C18H14ClN3O.C18H15N3O.C17H12ClN3O.C17H13N3O.C16H9ClFN3O.C16H10ClN3O.C16H10FN3O.C16H11N3O/c1-3-21(29)28-16-6-4-5-13(7-16)14-8-18-19(12-27-23(18)26-11-14)17-9-15(24)10-20(25)22(17)30-2;1-2-3-7-17(23)22-14-6-4-5-12(8-14)13-9-15-16(19)11-21-18(15)20-10-13;1-2-3-7-17(22)21-16-6-4-5-13(11-16)15-10-14-8-9-19-18(14)20-12-15;1-2-4-16(22)21-13-6-3-5-11(7-13)12-8-14-15(18)10-20-17(14)19-9-12;1-2-4-16(21)20-15-6-3-5-12(10-15)14-9-13-7-8-18-17(13)19-11-14;1-2-15(22)21-14-6-9(3-4-13(14)18)10-5-11-12(17)8-20-16(11)19-7-10;1-2-15(21)20-12-5-3-4-10(6-12)11-7-13-14(17)9-19-16(13)18-8-11;1-2-15(21)20-14-8-10(3-4-13(14)17)12-7-11-5-6-18-16(11)19-9-12;1-2-15(20)19-14-5-3-4-11(9-14)13-8-12-6-7-17-16(12)18-10-13/h3-12H,1H2,2H3,(H,26,27)(H,28,29);4-6,8-11H,2H2,1H3,(H,20,21)(H,22,23);4-6,8-12H,2H2,1H3,(H,19,20)(H,21,22);3,5-10H,1H3,(H,19,20)(H,21,22);3,5-11H,1H3,(H,18,19)(H,20,21);1,3-8H,(H,19,20)(H,21,22);2*1,3-9H,(H,18,19)(H,20,21);1,3-10H,(H,17,18)(H,19,20).

What are the key properties of N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide?

N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide has a molecular weight of 2753.60 g/mol, XLogP of 32.95, 21 rotatable bonds, 18 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-fluorophenyl]prop-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[2-fluoro-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pent-2-ynamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide is sourced from PubChem (CID 158344943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).