1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine

C222H252ClF4N27O2 — CID 159601427

IUPAC1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine
SMILESCC(C)(C)Cc1cc2cccnc2n1Cc1ccccc1.CC(C)(C)c1cc2cccnc2n1Cc1ccc(Cl)cc1.CC(C)(C)c1cc2cccnc2n1Cc1cncc(F)c1.CC(C)Cc1cc2cccnc2n1Cc1ccccc1.CC(c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.COc1ccc(Cn2c(C(C)(C)C)cc3cccnc32)cc1.COc1cccc(Cn2c(C(C)(C)C)cc3cccnc32)c1.C[C@@H](c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.C[C@H](c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.Cc1ccc2cc(C(C)(C)C)n(Cc3ccccc3)c2n1.Cc1ccnc2c1cc(C(C)(C)C)n2Cc1ccccc1.Cn1nc(C(F)(F)F)cc1Cn1c(C(C)(C)C)cc2cccnc21
InChIInChI=1S/2C19H22N2O.6C19H22N2.C18H19ClN2.C18H20N2.C17H19F3N4.C17H18FN3/c1-19(2,3)17-12-15-8-6-10-20-18(15)21(17)13-14-7-5-9-16(11-14)22-4;1-19(2,3)17-12-15-6-5-11-20-18(15)21(17)13-14-7-9-16(22-4)10-8-14;3*1-14(15-9-6-5-7-10-15)21-17(19(2,3)4)13-16-11-8-12-20-18(16)21;1-14-10-11-20-18-16(14)12-17(19(2,3)4)21(18)13-15-8-6-5-7-9-15;1-14-10-11-16-12-17(19(2,3)4)21(18(16)20-14)13-15-8-6-5-7-9-15;1-19(2,3)13-17-12-16-10-7-11-20-18(16)21(17)14-15-8-5-4-6-9-15;1-18(2,3)16-11-14-5-4-10-20-17(14)21(16)12-13-6-8-15(19)9-7-13;1-14(2)11-17-12-16-9-6-10-19-18(16)20(17)13-15-7-4-3-5-8-15;1-16(2,3)14-8-11-6-5-7-21-15(11)24(14)10-12-9-13(17(18,19)20)22-23(12)4;1-17(2,3)15-8-13-5-4-6-20-16(13)21(15)11-12-7-14(18)10-19-9-12/h2*5-12H,13H2,1-4H3;3*5-14H,1-4H3;2*5-12H,13H2,1-4H3;4-12H,13-14H2,1-3H3;4-11H,12H2,1-3H3;3-10,12,14H,11,13H2,1-2H3;5-9H,10H2,1-4H3;4-10H,11H2,1-3H3/t;;2*14-;;;;;;;;/m..10......../s1
InChIKeyMLNLREGTORQQRN-KXCDNQGZSA-N
MW3442.09 g/mol
LogP55.03
Rot. Bonds29

About 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine

1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine (PubChem CID 159601427) has the molecular formula C222H252ClF4N27O2 and a molecular weight of 3442.09 g/mol. Its IUPAC name is 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine
PubChem CID159601427
Molecular FormulaC222H252ClF4N27O2
Molecular Weight3442.09 g/mol
Exact Mass3439.01
IUPAC Name1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine
SMILESCC(C)(C)Cc1cc2cccnc2n1Cc1ccccc1.CC(C)(C)c1cc2cccnc2n1Cc1ccc(Cl)cc1.CC(C)(C)c1cc2cccnc2n1Cc1cncc(F)c1.CC(C)Cc1cc2cccnc2n1Cc1ccccc1.CC(c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.COc1ccc(Cn2c(C(C)(C)C)cc3cccnc32)cc1.COc1cccc(Cn2c(C(C)(C)C)cc3cccnc32)c1.C[C@@H](c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.C[C@H](c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.Cc1ccc2cc(C(C)(C)C)n(Cc3ccccc3)c2n1.Cc1ccnc2c1cc(C(C)(C)C)n2Cc1ccccc1.Cn1nc(C(F)(F)F)cc1Cn1c(C(C)(C)C)cc2cccnc21
InChIInChI=1S/2C19H22N2O.6C19H22N2.C18H19ClN2.C18H20N2.C17H19F3N4.C17H18FN3/c1-19(2,3)17-12-15-8-6-10-20-18(15)21(17)13-14-7-5-9-16(11-14)22-4;1-19(2,3)17-12-15-6-5-11-20-18(15)21(17)13-14-7-9-16(22-4)10-8-14;3*1-14(15-9-6-5-7-10-15)21-17(19(2,3)4)13-16-11-8-12-20-18(16)21;1-14-10-11-20-18-16(14)12-17(19(2,3)4)21(18)13-15-8-6-5-7-9-15;1-14-10-11-16-12-17(19(2,3)4)21(18(16)20-14)13-15-8-6-5-7-9-15;1-19(2,3)13-17-12-16-10-7-11-20-18(16)21(17)14-15-8-5-4-6-9-15;1-18(2,3)16-11-14-5-4-10-20-17(14)21(16)12-13-6-8-15(19)9-7-13;1-14(2)11-17-12-16-9-6-10-19-18(16)20(17)13-15-7-4-3-5-8-15;1-16(2,3)14-8-11-6-5-7-21-15(11)24(14)10-12-9-13(17(18,19)20)22-23(12)4;1-17(2,3)15-8-13-5-4-6-20-16(13)21(15)11-12-7-14(18)10-19-9-12/h2*5-12H,13H2,1-4H3;3*5-14H,1-4H3;2*5-12H,13H2,1-4H3;4-12H,13-14H2,1-3H3;4-11H,12H2,1-3H3;3-10,12,14H,11,13H2,1-2H3;5-9H,10H2,1-4H3;4-10H,11H2,1-3H3/t;;2*14-;;;;;;;;/m..10......../s1
InChIKeyMLNLREGTORQQRN-KXCDNQGZSA-N
XLogP55.03
TPSA263.01 Ų
H-Bond Donors
H-Bond Acceptors29
Rotatable Bonds29
Heavy Atoms256
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003442.09
LogP ≤ 555.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1029

Analyze 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine?
The IUPAC name of 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine (CID 159601427) is 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine?
The canonical SMILES for 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine is CC(C)(C)Cc1cc2cccnc2n1Cc1ccccc1.CC(C)(C)c1cc2cccnc2n1Cc1ccc(Cl)cc1.CC(C)(C)c1cc2cccnc2n1Cc1cncc(F)c1.CC(C)Cc1cc2cccnc2n1Cc1ccccc1.CC(c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.COc1ccc(Cn2c(C(C)(C)C)cc3cccnc32)cc1.COc1cccc(Cn2c(C(C)(C)C)cc3cccnc32)c1.C[C@@H](c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.C[C@H](c1ccccc1)n1c(C(C)(C)C)cc2cccnc21.Cc1ccc2cc(C(C)(C)C)n(Cc3ccccc3)c2n1.Cc1ccnc2c1cc(C(C)(C)C)n2Cc1ccccc1.Cn1nc(C(F)(F)F)cc1Cn1c(C(C)(C)C)cc2cccnc21.
What is the InChIKey of 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine?
The InChIKey is MLNLREGTORQQRN-KXCDNQGZSA-N. The full InChI is InChI=1S/2C19H22N2O.6C19H22N2.C18H19ClN2.C18H20N2.C17H19F3N4.C17H18FN3/c1-19(2,3)17-12-15-8-6-10-20-18(15)21(17)13-14-7-5-9-16(11-14)22-4;1-19(2,3)17-12-15-6-5-11-20-18(15)21(17)13-14-7-9-16(22-4)10-8-14;3*1-14(15-9-6-5-7-10-15)21-17(19(2,3)4)13-16-11-8-12-20-18(16)21;1-14-10-11-20-18-16(14)12-17(19(2,3)4)21(18)13-15-8-6-5-7-9-15;1-14-10-11-16-12-17(19(2,3)4)21(18(16)20-14)13-15-8-6-5-7-9-15;1-19(2,3)13-17-12-16-10-7-11-20-18(16)21(17)14-15-8-5-4-6-9-15;1-18(2,3)16-11-14-5-4-10-20-17(14)21(16)12-13-6-8-15(19)9-7-13;1-14(2)11-17-12-16-9-6-10-19-18(16)20(17)13-15-7-4-3-5-8-15;1-16(2,3)14-8-11-6-5-7-21-15(11)24(14)10-12-9-13(17(18,19)20)22-23(12)4;1-17(2,3)15-8-13-5-4-6-20-16(13)21(15)11-12-7-14(18)10-19-9-12/h2*5-12H,13H2,1-4H3;3*5-14H,1-4H3;2*5-12H,13H2,1-4H3;4-12H,13-14H2,1-3H3;4-11H,12H2,1-3H3;3-10,12,14H,11,13H2,1-2H3;5-9H,10H2,1-4H3;4-10H,11H2,1-3H3/t;;2*14-;;;;;;;;/m..10......../s1.
What are the key properties of 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine?
1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine has a molecular weight of 3442.09 g/mol, XLogP of 55.03, 29 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-tert-butyl-4-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-tert-butyl-6-methylpyrrolo[2,3-b]pyridine;1-benzyl-2-(2,2-dimethylpropyl)pyrrolo[2,3-b]pyridine;1-benzyl-2-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-chlorophenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(5-fluoro-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1S)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1R)-1-phenylethyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-(1-phenylethyl)pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 159601427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).