6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol

C97H79Cl3F3N15O8 — CID 159598604

About 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol

6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol (PubChem CID 159598604) has the molecular formula C97H79Cl3F3N15O8 and a molecular weight of 1746.15 g/mol. Its IUPAC name is 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol.

Molecular Properties

• Compound Name: 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol
• PubChem CID: 159598604
• Molecular Formula: C97H79Cl3F3N15O8
• Molecular Weight: 1746.15 g/mol
• Exact Mass: 1743.53
• IUPAC Name: 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol
• SMILES: Cc1cccc(COc2ccc(C(=O)c3c[nH]c4ncccc34)cn2)c1.Cc1cccc(COc2ccc(C(O)c3c[nH]c4ncccc34)cn2)c1.Cc1cccc(COc2ccc(Cc3c[nH]c4ncccc34)cn2)c1.O=C(Cl)c1ccc(Cl)nc1.O=C(c1ccc(Cl)nc1)c1c[nH]c2ncccc12.OCc1cccc(C(F)(F)F)c1.c1cnc2[nH]ccc2c1
• InChI: InChI=1S/C21H19N3O2.C21H17N3O2.C21H19N3O.C13H8ClN3O.C8H7F3O.C7H6N2.C6H3Cl2NO/c2*1-14-4-2-5-15(10-14)13-26-19-8-7-16(11-23-19)20(25)18-12-24-21-17(18)6-3-9-22-21;1-15-4-2-5-17(10-15)14-25-20-8-7-16(12-23-20)11-18-13-24-21-19(18)6-3-9-22-21;14-11-4-3-8(6-16-11)12(18)10-7-17-13-9(10)2-1-5-15-13;9-8(10,11)7-3-1-2-6(4-7)5-12;1-2-6-3-5-9-7(6)8-4-1;7-5-2-1-4(3-9-5)6(8)10/h2-12,20,25H,13H2,1H3,(H,22,24);2-12H,13H2,1H3,(H,22,24);2-10,12-13H,11,14H2,1H3,(H,22,24);1-7H,(H,15,17);1-4,12H,5H2;1-5H,(H,8,9);1-3H
• InChIKey: MLEBRULWODKCLM-UHFFFAOYSA-N
• XLogP: 21.16
• TPSA: 327.21 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 18
• Rotatable Bonds: 19
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1746.15
LogP ≤ 5	21.16
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	18

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 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol?

The IUPAC name of 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol (CID 159598604) is 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol.

What is the SMILES notation for 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol?

The canonical SMILES for 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol is Cc1cccc(COc2ccc(C(=O)c3c[nH]c4ncccc34)cn2)c1.Cc1cccc(COc2ccc(C(O)c3c[nH]c4ncccc34)cn2)c1.Cc1cccc(COc2ccc(Cc3c[nH]c4ncccc34)cn2)c1.O=C(Cl)c1ccc(Cl)nc1.O=C(c1ccc(Cl)nc1)c1c[nH]c2ncccc12.OCc1cccc(C(F)(F)F)c1.c1cnc2[nH]ccc2c1.

What is the InChIKey of 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol?

The InChIKey is MLEBRULWODKCLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2.C21H17N3O2.C21H19N3O.C13H8ClN3O.C8H7F3O.C7H6N2.C6H3Cl2NO/c2*1-14-4-2-5-15(10-14)13-26-19-8-7-16(11-23-19)20(25)18-12-24-21-17(18)6-3-9-22-21;1-15-4-2-5-17(10-15)14-25-20-8-7-16(12-23-20)11-18-13-24-21-19(18)6-3-9-22-21;14-11-4-3-8(6-16-11)12(18)10-7-17-13-9(10)2-1-5-15-13;9-8(10,11)7-3-1-2-6(4-7)5-12;1-2-6-3-5-9-7(6)8-4-1;7-5-2-1-4(3-9-5)6(8)10/h2-12,20,25H,13H2,1H3,(H,22,24);2-12H,13H2,1H3,(H,22,24);2-10,12-13H,11,14H2,1H3,(H,22,24);1-7H,(H,15,17);1-4,12H,5H2;1-5H,(H,8,9);1-3H.

What are the key properties of 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol?

6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol has a molecular weight of 1746.15 g/mol, XLogP of 21.16, 19 rotatable bonds, 7 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloropyridine-3-carbonyl chloride;(6-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[[6-[(3-methylphenyl)methoxy]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[6-[(3-methylphenyl)methoxy]-3-pyridinyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;1H-pyrrolo[2,3-b]pyridine;[3-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 159598604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).