4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one

C208H217F4N33O20 — CID 158894169

IUPAC4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one
SMILESO=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC(O)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC=CC2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CCC(F)(F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CCC[C@H](O)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@@H](F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@H](F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@H](O)C2)c1.O=C1CN(CCn2ncc3cc(N4CC=C(Oc5ccc(C6CC6)cc5)C4=O)ccc32)CCN1
InChIInChI=1S/C27H30N4O3.C26H26F2N4O2.2C26H27FN4O2.C26H27N5O3.C26H28N4O3.C26H26N4O2.C25H26N4O3/c32-23-2-1-12-29(18-23)14-15-31-25-10-7-22(16-21(25)17-28-31)30-13-11-26(27(30)33)34-24-8-5-20(6-9-24)19-3-4-19;27-26(28)10-12-30(17-26)13-14-32-23-8-5-21(15-20(23)16-29-32)31-11-9-24(25(31)33)34-22-6-3-19(4-7-22)18-1-2-18;2*27-21-9-11-29(17-21)13-14-31-24-8-5-22(15-20(24)16-28-31)30-12-10-25(26(30)32)33-23-6-3-19(4-7-23)18-1-2-18;32-25-17-29(12-10-27-25)13-14-31-23-8-5-21(15-20(23)16-28-31)30-11-9-24(26(30)33)34-22-6-3-19(4-7-22)18-1-2-18;31-22-9-11-28(17-22)13-14-30-24-8-5-21(15-20(24)16-27-30)29-12-10-25(26(29)32)33-23-6-3-19(4-7-23)18-1-2-18;31-26-25(32-23-8-5-20(6-9-23)19-3-4-19)11-14-29(26)22-7-10-24-21(17-22)18-27-30(24)16-15-28-12-1-2-13-28;30-21-15-27(16-21)11-12-29-23-8-5-20(13-19(23)14-26-29)28-10-9-24(25(28)31)32-22-6-3-18(4-7-22)17-1-2-17/h5-11,16-17,19,23,32H,1-4,12-15,18H2;3-9,15-16,18H,1-2,10-14,17H2;2*3-8,10,15-16,18,21H,1-2,9,11-14,17H2;3-9,15-16,18H,1-2,10-14,17H2,(H,27,32);3-8,10,15-16,18,22,31H,1-2,9,11-14,17H2;1-2,5-11,17-19H,3-4,12-16H2;3-9,13-14,17,21,30H,1-2,10-12,15-16H2/t23-;;2*21-;;22-;;/m0.10.0../s1
InChIKeyJEPUYHVPFSSSIR-DZOSGMDASA-N
MW3575.23 g/mol
LogP29.72
Rot. Bonds56

About 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one

4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one (PubChem CID 158894169) has the molecular formula C208H217F4N33O20 and a molecular weight of 3575.23 g/mol. Its IUPAC name is 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one.

Molecular Properties

Compound Name4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one
PubChem CID158894169
Molecular FormulaC208H217F4N33O20
Molecular Weight3575.23 g/mol
Exact Mass3572.69
IUPAC Name4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one
SMILESO=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC(O)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC=CC2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CCC(F)(F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CCC[C@H](O)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@@H](F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@H](F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@H](O)C2)c1.O=C1CN(CCn2ncc3cc(N4CC=C(Oc5ccc(C6CC6)cc5)C4=O)ccc32)CCN1
InChIInChI=1S/C27H30N4O3.C26H26F2N4O2.2C26H27FN4O2.C26H27N5O3.C26H28N4O3.C26H26N4O2.C25H26N4O3/c32-23-2-1-12-29(18-23)14-15-31-25-10-7-22(16-21(25)17-28-31)30-13-11-26(27(30)33)34-24-8-5-20(6-9-24)19-3-4-19;27-26(28)10-12-30(17-26)13-14-32-23-8-5-21(15-20(23)16-29-32)31-11-9-24(25(31)33)34-22-6-3-19(4-7-22)18-1-2-18;2*27-21-9-11-29(17-21)13-14-31-24-8-5-22(15-20(24)16-28-31)30-12-10-25(26(30)32)33-23-6-3-19(4-7-23)18-1-2-18;32-25-17-29(12-10-27-25)13-14-31-23-8-5-21(15-20(23)16-28-31)30-11-9-24(26(30)33)34-22-6-3-19(4-7-22)18-1-2-18;31-22-9-11-28(17-22)13-14-30-24-8-5-21(15-20(24)16-27-30)29-12-10-25(26(29)32)33-23-6-3-19(4-7-23)18-1-2-18;31-26-25(32-23-8-5-20(6-9-23)19-3-4-19)11-14-29(26)22-7-10-24-21(17-22)18-27-30(24)16-15-28-12-1-2-13-28;30-21-15-27(16-21)11-12-29-23-8-5-20(13-19(23)14-26-29)28-10-9-24(25(28)31)32-22-6-3-18(4-7-22)17-1-2-17/h5-11,16-17,19,23,32H,1-4,12-15,18H2;3-9,15-16,18H,1-2,10-14,17H2;2*3-8,10,15-16,18,21H,1-2,9,11-14,17H2;3-9,15-16,18H,1-2,10-14,17H2,(H,27,32);3-8,10,15-16,18,22,31H,1-2,9,11-14,17H2;1-2,5-11,17-19H,3-4,12-16H2;3-9,13-14,17,21,30H,1-2,10-12,15-16H2/t23-;;2*21-;;22-;;/m0.10.0../s1
InChIKeyJEPUYHVPFSSSIR-DZOSGMDASA-N
XLogP29.72
TPSA494.59 Ų
H-Bond Donors4
H-Bond Acceptors44
Rotatable Bonds56
Heavy Atoms265
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003575.23
LogP ≤ 529.72
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1044

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one with MolForge

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Related Compounds

1-[4-[2-(azetidin-1-yl)ethoxy]cyclohexyl]-4-(4-cyclopropylphenoxy)-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[4-[2-(4,4-difluoropiperidin-1-yl)ethoxy]cyclohexyl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(4,4-difluoropiperidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[4-[2-(3-hydroxyazetidin-1-yl)ethoxy]cyclohexyl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[4-[2-(3-hydroxy-3-methylazetidin-1-yl)ethoxy]cyclohexyl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[4-[2-[(3R)-3-hydroxypyrrolidin-1-yl]ethoxy]cyclohexyl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[4-[2-(3-methoxyazetidin-1-yl)ethoxy]cyclohexyl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]-2H-pyrrol-5-one
CID 157812770
1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-4-[4-(trifluoromethyl)phenyl]pyridin-2-one;4-(4-methoxy-2-methylphenyl)-1-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]pyridin-2-one;1-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]-4-[4-(trifluoromethoxy)phenyl]pyridin-2-one
CID 161171007
1-[1-[2-(azetidin-1-yl)ethyl]indazol-5-yl]-4-(4-cyclopropylphenoxy)-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxy-3-methylazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-methoxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one
CID 160922911

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one?
The IUPAC name of 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one (CID 158894169) is 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one.
What is the SMILES notation for 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one?
The canonical SMILES for 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one is O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC(O)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC=CC2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CCC(F)(F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CCC[C@H](O)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@@H](F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@H](F)C2)c1.O=C1C(Oc2ccc(C3CC3)cc2)=CCN1c1ccc2c(cnn2CCN2CC[C@H](O)C2)c1.O=C1CN(CCn2ncc3cc(N4CC=C(Oc5ccc(C6CC6)cc5)C4=O)ccc32)CCN1.
What is the InChIKey of 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one?
The InChIKey is JEPUYHVPFSSSIR-DZOSGMDASA-N. The full InChI is InChI=1S/C27H30N4O3.C26H26F2N4O2.2C26H27FN4O2.C26H27N5O3.C26H28N4O3.C26H26N4O2.C25H26N4O3/c32-23-2-1-12-29(18-23)14-15-31-25-10-7-22(16-21(25)17-28-31)30-13-11-26(27(30)33)34-24-8-5-20(6-9-24)19-3-4-19;27-26(28)10-12-30(17-26)13-14-32-23-8-5-21(15-20(23)16-29-32)31-11-9-24(25(31)33)34-22-6-3-19(4-7-22)18-1-2-18;2*27-21-9-11-29(17-21)13-14-31-24-8-5-22(15-20(24)16-28-31)30-12-10-25(26(30)32)33-23-6-3-19(4-7-23)18-1-2-18;32-25-17-29(12-10-27-25)13-14-31-23-8-5-21(15-20(23)16-28-31)30-11-9-24(26(30)33)34-22-6-3-19(4-7-22)18-1-2-18;31-22-9-11-28(17-22)13-14-30-24-8-5-21(15-20(24)16-27-30)29-12-10-25(26(29)32)33-23-6-3-19(4-7-23)18-1-2-18;31-26-25(32-23-8-5-20(6-9-23)19-3-4-19)11-14-29(26)22-7-10-24-21(17-22)18-27-30(24)16-15-28-12-1-2-13-28;30-21-15-27(16-21)11-12-29-23-8-5-20(13-19(23)14-26-29)28-10-9-24(25(28)31)32-22-6-3-18(4-7-22)17-1-2-17/h5-11,16-17,19,23,32H,1-4,12-15,18H2;3-9,15-16,18H,1-2,10-14,17H2;2*3-8,10,15-16,18,21H,1-2,9,11-14,17H2;3-9,15-16,18H,1-2,10-14,17H2,(H,27,32);3-8,10,15-16,18,22,31H,1-2,9,11-14,17H2;1-2,5-11,17-19H,3-4,12-16H2;3-9,13-14,17,21,30H,1-2,10-12,15-16H2/t23-;;2*21-;;22-;;/m0.10.0../s1.
What are the key properties of 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one?
4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one has a molecular weight of 3575.23 g/mol, XLogP of 29.72, 56 rotatable bonds, 4 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopropylphenoxy)-1-[1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(2,5-dihydropyrrol-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-(3-hydroxyazetidin-1-yl)ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypiperidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-(4-cyclopropylphenoxy)-1-[1-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethyl]indazol-5-yl]-2H-pyrrol-5-one;4-[2-[5-[4-(4-cyclopropylphenoxy)-5-oxo-2H-pyrrol-1-yl]indazol-1-yl]ethyl]piperazin-2-one is sourced from PubChem (CID 158894169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).