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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one

C140H116Cl6FN25O10 — CID 157077674

About 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one

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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one (PubChem CID 157077674) has the molecular formula C140H116Cl6FN25O10 and a molecular weight of 2540.35 g/mol. Its IUPAC name is 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one.

Molecular Properties

• Compound Name: 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one
• PubChem CID: 157077674
• Molecular Formula: C140H116Cl6FN25O10
• Molecular Weight: 2540.35 g/mol
• Exact Mass: 2535.75
• IUPAC Name: 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one
• SMILES: C#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.C=CC(=O)N1CCCC1C(=O)Cc1cnc2[nH]ccc2c1.C=CC(=O)N1CCCC1C(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.CC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(C)c3c2)c1.CC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.CCC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.O=C(CF)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.O=C(Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1)C1CCCC1
• InChI: InChI=1S/C21H19ClN4O2.C19H18ClN3O.C18H14ClN3O.C18H15N3O.C17H12ClN3O.C16H10ClN3O.C16H17N3O2.C15H11ClFN3O/c1-2-19(27)26-8-4-7-18(26)21(28)25-15-6-3-5-13(9-15)14-10-16-17(22)12-24-20(16)23-11-14;20-17-11-22-18-16(17)9-14(10-21-18)13-6-3-7-15(8-13)23-19(24)12-4-1-2-5-12;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;1-3-5-17(22)21-15-7-4-6-13(8-15)14-9-16-12(2)10-19-18(16)20-11-14;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;1-2-15(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)19-7-3-4-13(19)14(20)9-11-8-12-5-6-17-16(12)18-10-11;16-13-8-19-15-12(13)5-10(7-18-15)9-2-1-3-11(4-9)20-14(21)6-17/h2-3,5-6,9-12,18H,1,4,7-8H2,(H,23,24)(H,25,28);3,6-12H,1-2,4-5H2,(H,21,22)(H,23,24);4-6,8-11H,2H2,1H3,(H,20,21)(H,22,23);4,6-11H,1-2H3,(H,19,20)(H,21,22);3,5-10H,1H3,(H,19,20)(H,21,22);1,3-9H,(H,18,19)(H,20,21);2,5-6,8,10,13H,1,3-4,7,9H2,(H,17,18);1-5,7-8H,6H2,(H,18,19)(H,20,21)
• InChIKey: ADDXEJWDTXOUFF-UHFFFAOYSA-N
• XLogP: 29.69
• TPSA: 490.83 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 18
• Rotatable Bonds: 22
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2540.35
LogP ≤ 5	29.69
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	18

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-[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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one?

The IUPAC name of 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one (CID 157077674) is 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one.

What is the SMILES notation for 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one?

The canonical SMILES for 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one is C#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.C=CC(=O)N1CCCC1C(=O)Cc1cnc2[nH]ccc2c1.C=CC(=O)N1CCCC1C(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.CC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(C)c3c2)c1.CC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.CCC#CC(=O)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.O=C(CF)Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1.O=C(Nc1cccc(-c2cnc3[nH]cc(Cl)c3c2)c1)C1CCCC1.

What is the InChIKey of 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one?

The InChIKey is ADDXEJWDTXOUFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN4O2.C19H18ClN3O.C18H14ClN3O.C18H15N3O.C17H12ClN3O.C16H10ClN3O.C16H17N3O2.C15H11ClFN3O/c1-2-19(27)26-8-4-7-18(26)21(28)25-15-6-3-5-13(9-15)14-10-16-17(22)12-24-20(16)23-11-14;20-17-11-22-18-16(17)9-14(10-21-18)13-6-3-7-15(8-13)23-19(24)12-4-1-2-5-12;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;1-3-5-17(22)21-15-7-4-6-13(8-15)14-9-16-12(2)10-19-18(16)20-11-14;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;1-2-15(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)19-7-3-4-13(19)14(20)9-11-8-12-5-6-17-16(12)18-10-11;16-13-8-19-15-12(13)5-10(7-18-15)9-2-1-3-11(4-9)20-14(21)6-17/h2-3,5-6,9-12,18H,1,4,7-8H2,(H,23,24)(H,25,28);3,6-12H,1-2,4-5H2,(H,21,22)(H,23,24);4-6,8-11H,2H2,1H3,(H,20,21)(H,22,23);4,6-11H,1-2H3,(H,19,20)(H,21,22);3,5-10H,1H3,(H,19,20)(H,21,22);1,3-9H,(H,18,19)(H,20,21);2,5-6,8,10,13H,1,3-4,7,9H2,(H,17,18);1-5,7-8H,6H2,(H,18,19)(H,20,21).

What are the key properties of 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one?

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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one has a molecular weight of 2540.35 g/mol, XLogP of 29.69, 22 rotatable bonds, 15 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 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]cyclopentanecarboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-2-fluoroacetamide;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]-1-prop-2-enoylpyrrolidine-2-carboxamide;N-[3-(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]prop-2-ynamide;N-[3-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]but-2-ynamide;1-[2-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]pyrrolidin-1-yl]prop-2-en-1-one is sourced from PubChem (CID 157077674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).