[2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine

C65H61Cl10N11O5 — CID 160618251

About [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine

[2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine (PubChem CID 160618251) has the molecular formula C65H61Cl10N11O5 and a molecular weight of 1430.80 g/mol. Its IUPAC name is [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

• Compound Name: [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine
• PubChem CID: 160618251
• Molecular Formula: C65H61Cl10N11O5
• Molecular Weight: 1430.80 g/mol
• Exact Mass: 1425.17
• IUPAC Name: [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine
• SMILES: C.C.C.C.C.NCc1ccc(Cl)cc1.O=C(Cl)c1ccc(Cl)nc1Cl.O=C(O)c1ccc(Cl)nc1Cl.O=C(c1ccc(CCc2ccc(Cl)cc2)nc1Cl)c1c[nH]c2ncccc12.O=C(c1ccc(Cl)nc1Cl)c1c[nH]c2ncccc12.c1cnc2[nH]ccc2c1
• InChI: InChI=1S/C21H15Cl2N3O.C13H7Cl2N3O.C7H8ClN.C7H6N2.C6H2Cl3NO.C6H3Cl2NO2.5CH4/c22-14-6-3-13(4-7-14)5-8-15-9-10-17(20(23)26-15)19(27)18-12-25-21-16(18)2-1-11-24-21;14-10-4-3-8(12(15)18-10)11(19)9-6-17-13-7(9)2-1-5-16-13;8-7-3-1-6(5-9)2-4-7;1-2-6-3-5-9-7(6)8-4-1;7-4-2-1-3(6(9)11)5(8)10-4;7-4-2-1-3(6(10)11)5(8)9-4;;;;;/h1-4,6-7,9-12H,5,8H2,(H,24,25);1-6H,(H,16,17);1-4H,5,9H2;1-5H,(H,8,9);1-2H;1-2H,(H,10,11);5*1H4
• InChIKey: RGJGQIFQLLYKHH-UHFFFAOYSA-N
• XLogP: 20.17
• TPSA: 252.13 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 12
• Rotatable Bonds: 10
• Heavy Atoms: 91
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1430.80
LogP ≤ 5	20.17
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine?

The IUPAC name of [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine (CID 160618251) is [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine.

What is the SMILES notation for [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine?

The canonical SMILES for [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine is C.C.C.C.C.NCc1ccc(Cl)cc1.O=C(Cl)c1ccc(Cl)nc1Cl.O=C(O)c1ccc(Cl)nc1Cl.O=C(c1ccc(CCc2ccc(Cl)cc2)nc1Cl)c1c[nH]c2ncccc12.O=C(c1ccc(Cl)nc1Cl)c1c[nH]c2ncccc12.c1cnc2[nH]ccc2c1.

What is the InChIKey of [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine?

The InChIKey is RGJGQIFQLLYKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15Cl2N3O.C13H7Cl2N3O.C7H8ClN.C7H6N2.C6H2Cl3NO.C6H3Cl2NO2.5CH4/c22-14-6-3-13(4-7-14)5-8-15-9-10-17(20(23)26-15)19(27)18-12-25-21-16(18)2-1-11-24-21;14-10-4-3-8(12(15)18-10)11(19)9-6-17-13-7(9)2-1-5-16-13;8-7-3-1-6(5-9)2-4-7;1-2-6-3-5-9-7(6)8-4-1;7-4-2-1-3(6(9)11)5(8)10-4;7-4-2-1-3(6(10)11)5(8)9-4;;;;;/h1-4,6-7,9-12H,5,8H2,(H,24,25);1-6H,(H,16,17);1-4H,5,9H2;1-5H,(H,8,9);1-2H;1-2H,(H,10,11);5*1H4.

What are the key properties of [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine?

[2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine has a molecular weight of 1430.80 g/mol, XLogP of 20.17, 10 rotatable bonds, 5 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for [2-chloro-6-[2-(4-chlorophenyl)ethyl]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;(4-chlorophenyl)methanamine;2,6-dichloropyridine-3-carbonyl chloride;2,6-dichloropyridine-3-carboxylic acid;(2,6-dichloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;methane;1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 160618251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).