3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine

C130H105Cl6F11N10O18 — CID 158010006

About 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine

3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine (PubChem CID 158010006) has the molecular formula C130H105Cl6F11N10O18 and a molecular weight of 2517.02 g/mol. Its IUPAC name is 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

• Compound Name: 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine
• PubChem CID: 158010006
• Molecular Formula: C130H105Cl6F11N10O18
• Molecular Weight: 2517.02 g/mol
• Exact Mass: 2512.56
• IUPAC Name: 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine
• SMILES: COC(c1cccc(OCc2ccc(Cl)cc2F)c1OCCF)c1c[nH]c2ncccc12.FCCOc1c(Cc2c[nH]c3ncccc23)cccc1OCc1ccc(Cl)cc1F.O=C(O)c1cccc(OCc2ccc(Cl)cc2F)c1O.O=C(c1cccc(OCc2ccc(Cl)cc2F)c1OCCF)c1c[nH]c2ncccc12.O=Cc1cccc(OCc2ccc(Cl)cc2F)c1OCCF.OC(c1cccc(OCc2ccc(Cl)cc2F)c1OCCF)c1c[nH]c2ncccc12.c1cnc2[nH]ccc2c1
• InChI: InChI=1S/C24H21ClF2N2O3.C23H19ClF2N2O3.C23H17ClF2N2O3.C23H19ClF2N2O2.C16H13ClF2O3.C14H10ClFO4.C7H6N2/c1-30-22(19-13-29-24-17(19)5-3-10-28-24)18-4-2-6-21(23(18)31-11-9-26)32-14-15-7-8-16(25)12-20(15)27;2*24-15-7-6-14(19(26)11-15)13-31-20-5-1-3-17(22(20)30-10-8-25)21(29)18-12-28-23-16(18)4-2-9-27-23;24-18-7-6-16(20(26)12-18)14-30-21-5-1-3-15(22(21)29-10-8-25)11-17-13-28-23-19(17)4-2-9-27-23;17-13-5-4-12(14(19)8-13)10-22-15-3-1-2-11(9-20)16(15)21-7-6-18;15-9-5-4-8(11(16)6-9)7-20-12-3-1-2-10(13(12)17)14(18)19;1-2-6-3-5-9-7(6)8-4-1/h2-8,10,12-13,22H,9,11,14H2,1H3,(H,28,29);1-7,9,11-12,21,29H,8,10,13H2,(H,27,28);1-7,9,11-12H,8,10,13H2,(H,27,28);1-7,9,12-13H,8,10-11,14H2,(H,27,28);1-5,8-9H,6-7,10H2;1-6,17H,7H2,(H,18,19);1-5H,(H,8,9)
• InChIKey: FETOQOSRRKOVKN-UHFFFAOYSA-N
• XLogP: 32.01
• TPSA: 366.06 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 22
• Rotatable Bonds: 44
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2517.02
LogP ≤ 5	32.01
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine?

The IUPAC name of 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine (CID 158010006) is 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine.

What is the SMILES notation for 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine?

The canonical SMILES for 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine is COC(c1cccc(OCc2ccc(Cl)cc2F)c1OCCF)c1c[nH]c2ncccc12.FCCOc1c(Cc2c[nH]c3ncccc23)cccc1OCc1ccc(Cl)cc1F.O=C(O)c1cccc(OCc2ccc(Cl)cc2F)c1O.O=C(c1cccc(OCc2ccc(Cl)cc2F)c1OCCF)c1c[nH]c2ncccc12.O=Cc1cccc(OCc2ccc(Cl)cc2F)c1OCCF.OC(c1cccc(OCc2ccc(Cl)cc2F)c1OCCF)c1c[nH]c2ncccc12.c1cnc2[nH]ccc2c1.

What is the InChIKey of 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine?

The InChIKey is FETOQOSRRKOVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21ClF2N2O3.C23H19ClF2N2O3.C23H17ClF2N2O3.C23H19ClF2N2O2.C16H13ClF2O3.C14H10ClFO4.C7H6N2/c1-30-22(19-13-29-24-17(19)5-3-10-28-24)18-4-2-6-21(23(18)31-11-9-26)32-14-15-7-8-16(25)12-20(15)27;2*24-15-7-6-14(19(26)11-15)13-31-20-5-1-3-17(22(20)30-10-8-25)21(29)18-12-28-23-16(18)4-2-9-27-23;24-18-7-6-16(20(26)12-18)14-30-21-5-1-3-15(22(21)29-10-8-25)11-17-13-28-23-19(17)4-2-9-27-23;17-13-5-4-12(14(19)8-13)10-22-15-3-1-2-11(9-20)16(15)21-7-6-18;15-9-5-4-8(11(16)6-9)7-20-12-3-1-2-10(13(12)17)14(18)19;1-2-6-3-5-9-7(6)8-4-1/h2-8,10,12-13,22H,9,11,14H2,1H3,(H,28,29);1-7,9,11-12,21,29H,8,10,13H2,(H,27,28);1-7,9,11-12H,8,10,13H2,(H,27,28);1-7,9,12-13H,8,10-11,14H2,(H,27,28);1-5,8-9H,6-7,10H2;1-6,17H,7H2,(H,18,19);1-5H,(H,8,9).

What are the key properties of 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine?

3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine has a molecular weight of 2517.02 g/mol, XLogP of 32.01, 44 rotatable bonds, 8 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)benzaldehyde;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol;[3-[(4-chloro-2-fluorophenyl)methoxy]-2-(2-fluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone;3-[(4-chloro-2-fluorophenyl)methoxy]-2-hydroxybenzoic acid;1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 158010006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).