5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine

C111H108ClFN14O6 — CID 158638387

IUPAC5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
SMILESCCC(C)c1ccc(Cc2cnc3[nH]ccc3c2)cc1.CCCOc1ccc(Cc2cnc3[nH]ccc3c2)cc1.CCOc1ccc(Cc2cnc3[nH]ccc3c2)cc1.COc1cc(Cc2cnc3[nH]ccc3c2)cc(OC)c1OC.COc1ccc(Cc2cnc3[nH]ccc3c2)cc1.Clc1ccc(Cc2cnc3[nH]ccc3c2)cc1.Fc1ccc(Cc2cnc3[nH]ccc3c2)cc1
InChIInChI=1S/C18H20N2.C17H18N2O3.C17H18N2O.C16H16N2O.C15H14N2O.C14H11ClN2.C14H11FN2/c1-3-13(2)16-6-4-14(5-7-16)10-15-11-17-8-9-19-18(17)20-12-15;1-20-14-8-11(9-15(21-2)16(14)22-3)6-12-7-13-4-5-18-17(13)19-10-12;1-2-9-20-16-5-3-13(4-6-16)10-14-11-15-7-8-18-17(15)19-12-14;1-2-19-15-5-3-12(4-6-15)9-13-10-14-7-8-17-16(14)18-11-13;1-18-14-4-2-11(3-5-14)8-12-9-13-6-7-16-15(13)17-10-12;2*15-13-3-1-10(2-4-13)7-11-8-12-5-6-16-14(12)17-9-11/h4-9,11-13H,3,10H2,1-2H3,(H,19,20);4-5,7-10H,6H2,1-3H3,(H,18,19);3-8,11-12H,2,9-10H2,1H3,(H,18,19);3-8,10-11H,2,9H2,1H3,(H,17,18);2-7,9-10H,8H2,1H3,(H,16,17);2*1-6,8-9H,7H2,(H,16,17)
InChIKeyIABCVUSNJJEECA-UHFFFAOYSA-N
MW1788.63 g/mol
LogP25.60
Rot. Bonds25

About 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine

5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine (PubChem CID 158638387) has the molecular formula C111H108ClFN14O6 and a molecular weight of 1788.63 g/mol. Its IUPAC name is 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
PubChem CID158638387
Molecular FormulaC111H108ClFN14O6
Molecular Weight1788.63 g/mol
Exact Mass1786.82
IUPAC Name5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
SMILESCCC(C)c1ccc(Cc2cnc3[nH]ccc3c2)cc1.CCCOc1ccc(Cc2cnc3[nH]ccc3c2)cc1.CCOc1ccc(Cc2cnc3[nH]ccc3c2)cc1.COc1cc(Cc2cnc3[nH]ccc3c2)cc(OC)c1OC.COc1ccc(Cc2cnc3[nH]ccc3c2)cc1.Clc1ccc(Cc2cnc3[nH]ccc3c2)cc1.Fc1ccc(Cc2cnc3[nH]ccc3c2)cc1
InChIInChI=1S/C18H20N2.C17H18N2O3.C17H18N2O.C16H16N2O.C15H14N2O.C14H11ClN2.C14H11FN2/c1-3-13(2)16-6-4-14(5-7-16)10-15-11-17-8-9-19-18(17)20-12-15;1-20-14-8-11(9-15(21-2)16(14)22-3)6-12-7-13-4-5-18-17(13)19-10-12;1-2-9-20-16-5-3-13(4-6-16)10-14-11-15-7-8-18-17(15)19-12-14;1-2-19-15-5-3-12(4-6-15)9-13-10-14-7-8-17-16(14)18-11-13;1-18-14-4-2-11(3-5-14)8-12-9-13-6-7-16-15(13)17-10-12;2*15-13-3-1-10(2-4-13)7-11-8-12-5-6-16-14(12)17-9-11/h4-9,11-13H,3,10H2,1-2H3,(H,19,20);4-5,7-10H,6H2,1-3H3,(H,18,19);3-8,11-12H,2,9-10H2,1H3,(H,18,19);3-8,10-11H,2,9H2,1H3,(H,17,18);2-7,9-10H,8H2,1H3,(H,16,17);2*1-6,8-9H,7H2,(H,16,17)
InChIKeyIABCVUSNJJEECA-UHFFFAOYSA-N
XLogP25.60
TPSA256.14 Ų
H-Bond Donors7
H-Bond Acceptors13
Rotatable Bonds25
Heavy Atoms133
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001788.63
LogP ≤ 525.60
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1013

Analyze 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine with MolForge

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Related Compounds

3-(2-chloro-4-pyridinyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(3-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;5-(2-phenoxyphenyl)-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine;5-(2-phenoxyphenyl)-3-pyrimidin-5-yl-1H-pyrrolo[2,3-b]pyridine;5-(2-phenoxyphenyl)-3-[3-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine;5-(2-phenoxyphenyl)-3-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 158456002
5-chloro-3-[[6-fluoro-2-methoxy-3-(2-methoxyethoxy)phenyl]-methoxymethyl]-1H-pyrrolo[2,3-b]pyridine;3-[methoxy-[4-methoxy-3-(2,2,2-trifluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;3-[[4-methoxy-3-(2,2,2-trifluoroethoxy)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridine;[4-methoxy-3-(2,2,2-trifluoroethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanol
CID 160122028
5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;N-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;N-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-6-amine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;N-(3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-6-amine;N-(4-methoxyphenyl)-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 160931596
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
3-(2-chloro-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(2-fluorophenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-fluorophenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-fluorophenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine
CID 158136856
3-(6-chloro-3-pyridinyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2-chloro-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(2-fluorophenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-fluorophenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-fluorophenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(2-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;5-(2-phenoxyphenyl)-3-pyridin-2-yl-1H-pyrrolo[2,3-b]pyridine;5-phenyl-3-(2-phenylphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 158341017
5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3-chloro-4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
CID 159368733
3-(4-methoxy-3-methylphenyl)-5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1H-pyrrolo[2,3-b]pyridine;5-[4-[(4-methylphenyl)methoxy]phenyl]-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-7H-cyclopenta[b]pyridine;3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-(3-phenylmethoxyphenyl)-7H-cyclopenta[b]pyridine;3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-(3,4,5-trimethoxyphenyl)-7H-cyclopenta[b]pyridine
CID 159918751
bis(3-[[4-[(4-chlorophenyl)methoxy]-2,5-difluorophenyl]methyl]-1H-pyrrolo[2,3-b]pyridine);3-[(2,5-difluoro-4-phenylmethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;[3-[(2,5-difluoro-4-phenylmethoxyphenyl)methyl]pyrrolo[2,3-b]pyridin-1-yl]-tri(propan-2-yl)silane;2,5-difluoro-4-[[1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]phenol
CID 160116120
3-(3,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-methoxy-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)phenol;3-(3-phenylmethoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(4-phenylmethoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 160150122
5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-tert-butylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3-chloro-4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
CID 160383671
5-chloro-3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;tetrakis(3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine)
CID 160668055

Frequently Asked Questions

What is the IUPAC name of 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine (CID 158638387) is 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine is CCC(C)c1ccc(Cc2cnc3[nH]ccc3c2)cc1.CCCOc1ccc(Cc2cnc3[nH]ccc3c2)cc1.CCOc1ccc(Cc2cnc3[nH]ccc3c2)cc1.COc1cc(Cc2cnc3[nH]ccc3c2)cc(OC)c1OC.COc1ccc(Cc2cnc3[nH]ccc3c2)cc1.Clc1ccc(Cc2cnc3[nH]ccc3c2)cc1.Fc1ccc(Cc2cnc3[nH]ccc3c2)cc1.
What is the InChIKey of 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is IABCVUSNJJEECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2.C17H18N2O3.C17H18N2O.C16H16N2O.C15H14N2O.C14H11ClN2.C14H11FN2/c1-3-13(2)16-6-4-14(5-7-16)10-15-11-17-8-9-19-18(17)20-12-15;1-20-14-8-11(9-15(21-2)16(14)22-3)6-12-7-13-4-5-18-17(13)19-10-12;1-2-9-20-16-5-3-13(4-6-16)10-14-11-15-7-8-18-17(15)19-12-14;1-2-19-15-5-3-12(4-6-15)9-13-10-14-7-8-17-16(14)18-11-13;1-18-14-4-2-11(3-5-14)8-12-9-13-6-7-16-15(13)17-10-12;2*15-13-3-1-10(2-4-13)7-11-8-12-5-6-16-14(12)17-9-11/h4-9,11-13H,3,10H2,1-2H3,(H,19,20);4-5,7-10H,6H2,1-3H3,(H,18,19);3-8,11-12H,2,9-10H2,1H3,(H,18,19);3-8,10-11H,2,9H2,1H3,(H,17,18);2-7,9-10H,8H2,1H3,(H,16,17);2*1-6,8-9H,7H2,(H,16,17).
What are the key properties of 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine?
5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 1788.63 g/mol, XLogP of 25.60, 25 rotatable bonds, 7 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-butan-2-ylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-chlorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-ethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(4-propoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine;5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 158638387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).