1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol

C223H299F6N33O10 — CID 157281053

IUPAC1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol
SMILESCC(C)c1cn(C(C)C)c2ncc(F)cc12.CC(C)c1cn(C2CC2)c2ncccc12.CC(C)c1cn(C2CCCOC2)c2ncccc12.CC(C)c1cn(C2CCN(CCF)C2)c2ncccc12.CC(C)c1cn(C2CCOCC2)c2ncc(F)cc12.CC(C)c1cn(C2CCOCC2)c2ncccc12.CC(C)c1cn(CCCO)c2ncc(F)cc12.CC(C)c1cn(CCCO)c2ncccc12.CC(C)c1cn([C@@H]2CCCOC2)c2ncccc12.CC(C)c1cn([C@@H]2CCN(CCF)C2)c2ncccc12.CC(C)c1cn([C@H]2CCCOC2)c2ncccc12.CC(C)c1cn([C@H]2CCN(CCF)C2)c2ncccc12.COC1CCCC1n1cc(C(C)C)c2cccnc21.CO[C@@H]1CCC[C@H]1n1cc(C(C)C)c2cccnc21.CO[C@H]1CCC[C@@H]1n1cc(C(C)C)c2cccnc21
InChIInChI=1S/3C16H22FN3.3C16H22N2O.C15H19FN2O.4C15H20N2O.C13H17FN2O.C13H17FN2.C13H18N2O.C13H16N2/c3*1-12(2)15-11-20(16-14(15)4-3-7-18-16)13-5-8-19(10-13)9-6-17;3*1-11(2)13-10-18(14-7-4-8-15(14)19-3)16-12(13)6-5-9-17-16;1-10(2)14-9-18(12-3-5-19-6-4-12)15-13(14)7-11(16)8-17-15;3*1-11(2)14-9-17(12-5-4-8-18-10-12)15-13(14)6-3-7-16-15;1-11(2)14-10-17(12-5-8-18-9-6-12)15-13(14)4-3-7-16-15;1-9(2)12-8-16(4-3-5-17)13-11(12)6-10(14)7-15-13;1-8(2)12-7-16(9(3)4)13-11(12)5-10(14)6-15-13;1-10(2)12-9-15(7-4-8-16)13-11(12)5-3-6-14-13;1-9(2)12-8-15(10-5-6-10)13-11(12)4-3-7-14-13/h3*3-4,7,11-13H,5-6,8-10H2,1-2H3;3*5-6,9-11,14-15H,4,7-8H2,1-3H3;7-10,12H,3-6H2,1-2H3;3*3,6-7,9,11-12H,4-5,8,10H2,1-2H3;3-4,7,10-12H,5-6,8-9H2,1-2H3;6-9,17H,3-5H2,1-2H3;5-9H,1-4H3;3,5-6,9-10,16H,4,7-8H2,1-2H3;3-4,7-10H,5-6H2,1-2H3/t2*13-;;2*14-,15-;;;2*12-;;;;;;/m10.10..10....../s1
InChIKeyAZRBFIOOGNIFHM-VRQIVVCASA-N
MW3716.05 g/mol
LogP52.12
Rot. Bonds43

About 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol

1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol (PubChem CID 157281053) has the molecular formula C223H299F6N33O10 and a molecular weight of 3716.05 g/mol. Its IUPAC name is 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol.

Molecular Properties

Compound Name1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol
PubChem CID157281053
Molecular FormulaC223H299F6N33O10
Molecular Weight3716.05 g/mol
Exact Mass3713.38
IUPAC Name1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol
SMILESCC(C)c1cn(C(C)C)c2ncc(F)cc12.CC(C)c1cn(C2CC2)c2ncccc12.CC(C)c1cn(C2CCCOC2)c2ncccc12.CC(C)c1cn(C2CCN(CCF)C2)c2ncccc12.CC(C)c1cn(C2CCOCC2)c2ncc(F)cc12.CC(C)c1cn(C2CCOCC2)c2ncccc12.CC(C)c1cn(CCCO)c2ncc(F)cc12.CC(C)c1cn(CCCO)c2ncccc12.CC(C)c1cn([C@@H]2CCCOC2)c2ncccc12.CC(C)c1cn([C@@H]2CCN(CCF)C2)c2ncccc12.CC(C)c1cn([C@H]2CCCOC2)c2ncccc12.CC(C)c1cn([C@H]2CCN(CCF)C2)c2ncccc12.COC1CCCC1n1cc(C(C)C)c2cccnc21.CO[C@@H]1CCC[C@H]1n1cc(C(C)C)c2cccnc21.CO[C@H]1CCC[C@@H]1n1cc(C(C)C)c2cccnc21
InChIInChI=1S/3C16H22FN3.3C16H22N2O.C15H19FN2O.4C15H20N2O.C13H17FN2O.C13H17FN2.C13H18N2O.C13H16N2/c3*1-12(2)15-11-20(16-14(15)4-3-7-18-16)13-5-8-19(10-13)9-6-17;3*1-11(2)13-10-18(14-7-4-8-15(14)19-3)16-12(13)6-5-9-17-16;1-10(2)14-9-18(12-3-5-19-6-4-12)15-13(14)7-11(16)8-17-15;3*1-11(2)14-9-17(12-5-4-8-18-10-12)15-13(14)6-3-7-16-15;1-11(2)14-10-17(12-5-8-18-9-6-12)15-13(14)4-3-7-16-15;1-9(2)12-8-16(4-3-5-17)13-11(12)6-10(14)7-15-13;1-8(2)12-7-16(9(3)4)13-11(12)5-10(14)6-15-13;1-10(2)12-9-15(7-4-8-16)13-11(12)5-3-6-14-13;1-9(2)12-8-15(10-5-6-10)13-11(12)4-3-7-14-13/h3*3-4,7,11-13H,5-6,8-10H2,1-2H3;3*5-6,9-11,14-15H,4,7-8H2,1-3H3;7-10,12H,3-6H2,1-2H3;3*3,6-7,9,11-12H,4-5,8,10H2,1-2H3;3-4,7,10-12H,5-6,8-9H2,1-2H3;6-9,17H,3-5H2,1-2H3;5-9H,1-4H3;3,5-6,9-10,16H,4,7-8H2,1-2H3;3-4,7-10H,5-6H2,1-2H3/t2*13-;;2*14-,15-;;;2*12-;;;;;;/m10.10..10....../s1
InChIKeyAZRBFIOOGNIFHM-VRQIVVCASA-N
XLogP52.12
TPSA391.32 Ų
H-Bond Donors2
H-Bond Acceptors43
Rotatable Bonds43
Heavy Atoms272
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003716.05
LogP ≤ 552.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1043

Analyze 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol?
The IUPAC name of 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol (CID 157281053) is 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol.
What is the SMILES notation for 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol?
The canonical SMILES for 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol is CC(C)c1cn(C(C)C)c2ncc(F)cc12.CC(C)c1cn(C2CC2)c2ncccc12.CC(C)c1cn(C2CCCOC2)c2ncccc12.CC(C)c1cn(C2CCN(CCF)C2)c2ncccc12.CC(C)c1cn(C2CCOCC2)c2ncc(F)cc12.CC(C)c1cn(C2CCOCC2)c2ncccc12.CC(C)c1cn(CCCO)c2ncc(F)cc12.CC(C)c1cn(CCCO)c2ncccc12.CC(C)c1cn([C@@H]2CCCOC2)c2ncccc12.CC(C)c1cn([C@@H]2CCN(CCF)C2)c2ncccc12.CC(C)c1cn([C@H]2CCCOC2)c2ncccc12.CC(C)c1cn([C@H]2CCN(CCF)C2)c2ncccc12.COC1CCCC1n1cc(C(C)C)c2cccnc21.CO[C@@H]1CCC[C@H]1n1cc(C(C)C)c2cccnc21.CO[C@H]1CCC[C@@H]1n1cc(C(C)C)c2cccnc21.
What is the InChIKey of 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol?
The InChIKey is AZRBFIOOGNIFHM-VRQIVVCASA-N. The full InChI is InChI=1S/3C16H22FN3.3C16H22N2O.C15H19FN2O.4C15H20N2O.C13H17FN2O.C13H17FN2.C13H18N2O.C13H16N2/c3*1-12(2)15-11-20(16-14(15)4-3-7-18-16)13-5-8-19(10-13)9-6-17;3*1-11(2)13-10-18(14-7-4-8-15(14)19-3)16-12(13)6-5-9-17-16;1-10(2)14-9-18(12-3-5-19-6-4-12)15-13(14)7-11(16)8-17-15;3*1-11(2)14-9-17(12-5-4-8-18-10-12)15-13(14)6-3-7-16-15;1-11(2)14-10-17(12-5-8-18-9-6-12)15-13(14)4-3-7-16-15;1-9(2)12-8-16(4-3-5-17)13-11(12)6-10(14)7-15-13;1-8(2)12-7-16(9(3)4)13-11(12)5-10(14)6-15-13;1-10(2)12-9-15(7-4-8-16)13-11(12)5-3-6-14-13;1-9(2)12-8-15(10-5-6-10)13-11(12)4-3-7-14-13/h3*3-4,7,11-13H,5-6,8-10H2,1-2H3;3*5-6,9-11,14-15H,4,7-8H2,1-3H3;7-10,12H,3-6H2,1-2H3;3*3,6-7,9,11-12H,4-5,8,10H2,1-2H3;3-4,7,10-12H,5-6,8-9H2,1-2H3;6-9,17H,3-5H2,1-2H3;5-9H,1-4H3;3,5-6,9-10,16H,4,7-8H2,1-2H3;3-4,7-10H,5-6H2,1-2H3/t2*13-;;2*14-,15-;;;2*12-;;;;;;/m10.10..10....../s1.
What are the key properties of 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol?
1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol has a molecular weight of 3716.05 g/mol, XLogP of 52.12, 43 rotatable bonds, 2 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1-[1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-1-(2-fluoroethyl)pyrrolidin-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;5-fluoro-1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(5-fluoro-3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol;1-[(1S,2S)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(1R,2R)-2-methoxycyclopentyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(2-methoxycyclopentyl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-3-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3S)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-[(3R)-oxan-3-yl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(3-propan-2-ylpyrrolo[2,3-b]pyridin-1-yl)propan-1-ol is sourced from PubChem (CID 157281053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).