5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine — IUPAC name, SMILES, InChIKey & properties

Name: 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine

5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine (PubChem CID 158413761) has the molecular formula C96H69ClF4N10O7 and a molecular weight of 1586.12 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name	5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine
PubChem CID	158413761
Molecular Formula	C96H69ClF4N10O7
Molecular Weight	1586.12 g/mol
Exact Mass	1584.50
IUPAC Name	5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine
SMILES	CC(C)Oc1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.Cc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1F.Clc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1.FC(F)(F)Oc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1.c1ccc(-c2ccccc2-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1
InChI	InChI=1S/C23H16N2O.C20H18N2O2.C18H11F3N2O2.C18H13FN2O.C17H11ClN2O/c1-2-6-16(7-3-1)19-8-4-5-9-20(19)18-12-21-22(17-10-11-26-15-17)14-25-23(21)24-13-18;1-13(2)24-19-6-4-3-5-16(19)15-9-17-18(14-7-8-23-12-14)11-22-20(17)21-10-15;19-18(20,21)25-14-3-1-11(2-4-14)13-7-15-16(12-5-6-24-10-12)9-23-17(15)22-8-13;1-11-2-3-12(7-17(11)19)14-6-15-16(13-4-5-22-10-13)9-21-18(15)20-8-14;18-14-3-1-11(2-4-14)13-7-15-16(12-5-6-21-10-12)9-20-17(15)19-8-13/h1-15H,(H,24,25);3-13H,1-2H3,(H,21,22);1-10H,(H,22,23);2-10H,1H3,(H,20,21);1-10H,(H,19,20)
InChIKey	GZPYZUFBDWAKLT-UHFFFAOYSA-N
XLogP	26.90
TPSA	227.56 Å²
H-Bond Donors	5
H-Bond Acceptors	12
Rotatable Bonds	14
Heavy Atoms	118
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1586.12
LogP ≤ 5	26.90
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	12

Analyze 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine?

The IUPAC name of 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine (CID 158413761) is 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine.

What is the SMILES notation for 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine?

The canonical SMILES for 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine is CC(C)Oc1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.Cc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1F.Clc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1.FC(F)(F)Oc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1.c1ccc(-c2ccccc2-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1.

What is the InChIKey of 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine?

The InChIKey is GZPYZUFBDWAKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O.C20H18N2O2.C18H11F3N2O2.C18H13FN2O.C17H11ClN2O/c1-2-6-16(7-3-1)19-8-4-5-9-20(19)18-12-21-22(17-10-11-26-15-17)14-25-23(21)24-13-18;1-13(2)24-19-6-4-3-5-16(19)15-9-17-18(14-7-8-23-12-14)11-22-20(17)21-10-15;19-18(20,21)25-14-3-1-11(2-4-14)13-7-15-16(12-5-6-24-10-12)9-23-17(15)22-8-13;1-11-2-3-12(7-17(11)19)14-6-15-16(13-4-5-22-10-13)9-21-18(15)20-8-14;18-14-3-1-11(2-4-14)13-7-15-16(12-5-6-21-10-12)9-20-17(15)19-8-13/h1-15H,(H,24,25);3-13H,1-2H3,(H,21,22);1-10H,(H,22,23);2-10H,1H3,(H,20,21);1-10H,(H,19,20).

What are the key properties of 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine?

Where does this data come from?

All data for 5-(4-chlorophenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-fluoro-4-methylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 158413761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).