5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine

C150H139ClF4N26O9 — CID 162113770

About 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine

5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine (PubChem CID 162113770) has the molecular formula C150H139ClF4N26O9 and a molecular weight of 2561.38 g/mol. Its IUPAC name is 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

• Compound Name: 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
• PubChem CID: 162113770
• Molecular Formula: C150H139ClF4N26O9
• Molecular Weight: 2561.38 g/mol
• Exact Mass: 2559.08
• IUPAC Name: 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
• SMILES: CC(=O)Cc1cccc(Cc2cnc3[nH]ccc3c2)c1.COc1cc(Cc2cnc3[nH]ccc3c2)cc(OC)c1OC.COc1ccc(CNc2ccc3cc[nH]c3n2)cc1.COc1ccc(CNc2ccc3cc[nH]c3n2)cc1.COc1cccc(CNc2ccc3cc[nH]c3n2)c1.COc1cccc(CNc2ccc3cc[nH]c3n2)c1.Clc1ccc(Cc2cnc3[nH]ccc3c2)cc1.FC(F)(F)Oc1ccccc1CNc1ccc2cc[nH]c2n1.Fc1ccc(Cc2cnc3[nH]ccc3c2)cc1.c1ccc(Nc2ccc3cc[nH]c3n2)cc1
• InChI: InChI=1S/C17H18N2O3.C17H16N2O.C15H12F3N3O.4C15H15N3O.C14H11ClN2.C14H11FN2.C13H11N3/c1-20-14-8-11(9-15(21-2)16(14)22-3)6-12-7-13-4-5-18-17(13)19-10-12;1-12(20)7-13-3-2-4-14(8-13)9-15-10-16-5-6-18-17(16)19-11-15;16-15(17,18)22-12-4-2-1-3-11(12)9-20-13-6-5-10-7-8-19-14(10)21-13;2*1-19-13-5-2-11(3-6-13)10-17-14-7-4-12-8-9-16-15(12)18-14;2*1-19-13-4-2-3-11(9-13)10-17-14-6-5-12-7-8-16-15(12)18-14;2*15-13-3-1-10(2-4-13)7-11-8-12-5-6-16-14(12)17-9-11;1-2-4-11(5-3-1)15-12-7-6-10-8-9-14-13(10)16-12/h4-5,7-10H,6H2,1-3H3,(H,18,19);2-6,8,10-11H,7,9H2,1H3,(H,18,19);1-8H,9H2,(H2,19,20,21);4*2-9H,10H2,1H3,(H2,16,17,18);2*1-6,8-9H,7H2,(H,16,17);1-9H,(H2,14,15,16)
• InChIKey: ZGMMVKZGKILPTE-UHFFFAOYSA-N
• XLogP: 33.68
• TPSA: 449.89 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 25
• Rotatable Bonds: 35
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2561.38
LogP ≤ 5	33.68
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine?

The IUPAC name of 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine (CID 162113770) is 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine.

What is the SMILES notation for 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine?

The canonical SMILES for 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine is CC(=O)Cc1cccc(Cc2cnc3[nH]ccc3c2)c1.COc1cc(Cc2cnc3[nH]ccc3c2)cc(OC)c1OC.COc1ccc(CNc2ccc3cc[nH]c3n2)cc1.COc1ccc(CNc2ccc3cc[nH]c3n2)cc1.COc1cccc(CNc2ccc3cc[nH]c3n2)c1.COc1cccc(CNc2ccc3cc[nH]c3n2)c1.Clc1ccc(Cc2cnc3[nH]ccc3c2)cc1.FC(F)(F)Oc1ccccc1CNc1ccc2cc[nH]c2n1.Fc1ccc(Cc2cnc3[nH]ccc3c2)cc1.c1ccc(Nc2ccc3cc[nH]c3n2)cc1.

What is the InChIKey of 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine?

The InChIKey is ZGMMVKZGKILPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3.C17H16N2O.C15H12F3N3O.4C15H15N3O.C14H11ClN2.C14H11FN2.C13H11N3/c1-20-14-8-11(9-15(21-2)16(14)22-3)6-12-7-13-4-5-18-17(13)19-10-12;1-12(20)7-13-3-2-4-14(8-13)9-15-10-16-5-6-18-17(16)19-11-15;16-15(17,18)22-12-4-2-1-3-11(12)9-20-13-6-5-10-7-8-19-14(10)21-13;2*1-19-13-5-2-11(3-6-13)10-17-14-7-4-12-8-9-16-15(12)18-14;2*1-19-13-4-2-3-11(9-13)10-17-14-6-5-12-7-8-16-15(12)18-14;2*15-13-3-1-10(2-4-13)7-11-8-12-5-6-16-14(12)17-9-11;1-2-4-11(5-3-1)15-12-7-6-10-8-9-14-13(10)16-12/h4-5,7-10H,6H2,1-3H3,(H,18,19);2-6,8,10-11H,7,9H2,1H3,(H,18,19);1-8H,9H2,(H2,19,20,21);4*2-9H,10H2,1H3,(H2,16,17,18);2*1-6,8-9H,7H2,(H,16,17);1-9H,(H2,14,15,16).

What are the key properties of 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine?

5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 2561.38 g/mol, XLogP of 33.68, 35 rotatable bonds, 16 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;bis(N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);bis(N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine);N-phenyl-1H-pyrrolo[2,3-b]pyridin-6-amine;1-[3-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)phenyl]propan-2-one;N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 162113770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).