5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol

C108H101F12N15O6 — CID 160688018

About 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol

5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol (PubChem CID 160688018) has the molecular formula C108H101F12N15O6 and a molecular weight of 1933.07 g/mol. Its IUPAC name is 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol.

Molecular Properties

• Compound Name: 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol
• PubChem CID: 160688018
• Molecular Formula: C108H101F12N15O6
• Molecular Weight: 1933.07 g/mol
• Exact Mass: 1931.79
• IUPAC Name: 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol
• SMILES: CC(C)c1ccc(CN2CCc3cc(-c4cn[nH]c4)ccc32)cc1.Cc1cccc(-c2ccc3c(c2)CCN3Cc2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)n1.NC(=O)c1ccc(CN2CCc3cc(-c4cn[nH]c4)ccc32)cc1.O=c1[nH]cc(-c2ccc3c(c2)CCN3Cc2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)c(=O)[nH]1.OC1(c2ccc(CN3CCc4cc(-c5cn[nH]c5)ccc43)cc2)CCC1
• InChI: InChI=1S/C24H20F6N2O.C22H17F6N3O3.C22H23N3O.C21H23N3.C19H18N4O/c1-15-3-2-4-20(31-15)17-7-10-21-18(13-17)11-12-32(21)14-16-5-8-19(9-6-16)22(33,23(25,26)27)24(28,29)30;23-21(24,25)20(34,22(26,27)28)15-4-1-12(2-5-15)11-31-8-7-14-9-13(3-6-17(14)31)16-10-29-19(33)30-18(16)32;26-22(9-1-10-22)20-5-2-16(3-6-20)15-25-11-8-18-12-17(4-7-21(18)25)19-13-23-24-14-19;1-15(2)17-5-3-16(4-6-17)14-24-10-9-19-11-18(7-8-21(19)24)20-12-22-23-13-20;20-19(24)14-3-1-13(2-4-14)12-23-8-7-16-9-15(5-6-18(16)23)17-10-21-22-11-17/h2-10,13,33H,11-12,14H2,1H3;1-6,9-10,34H,7-8,11H2,(H2,29,30,32,33);2-7,12-14,26H,1,8-11,15H2,(H,23,24);3-8,11-13,15H,9-10,14H2,1-2H3,(H,22,23);1-6,9-11H,7-8,12H2,(H2,20,24)(H,21,22)
• InChIKey: RPAICWFKWKQILG-UHFFFAOYSA-N
• XLogP: 21.05
• TPSA: 284.63 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 15
• Rotatable Bonds: 20
• Heavy Atoms: 141
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1933.07
LogP ≤ 5	21.05
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol?

The IUPAC name of 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol (CID 160688018) is 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol.

What is the SMILES notation for 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol?

The canonical SMILES for 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol is CC(C)c1ccc(CN2CCc3cc(-c4cn[nH]c4)ccc32)cc1.Cc1cccc(-c2ccc3c(c2)CCN3Cc2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)n1.NC(=O)c1ccc(CN2CCc3cc(-c4cn[nH]c4)ccc32)cc1.O=c1[nH]cc(-c2ccc3c(c2)CCN3Cc2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)c(=O)[nH]1.OC1(c2ccc(CN3CCc4cc(-c5cn[nH]c5)ccc43)cc2)CCC1.

What is the InChIKey of 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol?

The InChIKey is RPAICWFKWKQILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F6N2O.C22H17F6N3O3.C22H23N3O.C21H23N3.C19H18N4O/c1-15-3-2-4-20(31-15)17-7-10-21-18(13-17)11-12-32(21)14-16-5-8-19(9-6-16)22(33,23(25,26)27)24(28,29)30;23-21(24,25)20(34,22(26,27)28)15-4-1-12(2-5-15)11-31-8-7-14-9-13(3-6-17(14)31)16-10-29-19(33)30-18(16)32;26-22(9-1-10-22)20-5-2-16(3-6-20)15-25-11-8-18-12-17(4-7-21(18)25)19-13-23-24-14-19;1-15(2)17-5-3-16(4-6-17)14-24-10-9-19-11-18(7-8-21(19)24)20-12-22-23-13-20;20-19(24)14-3-1-13(2-4-14)12-23-8-7-16-9-15(5-6-18(16)23)17-10-21-22-11-17/h2-10,13,33H,11-12,14H2,1H3;1-6,9-10,34H,7-8,11H2,(H2,29,30,32,33);2-7,12-14,26H,1,8-11,15H2,(H,23,24);3-8,11-13,15H,9-10,14H2,1-2H3,(H,22,23);1-6,9-11H,7-8,12H2,(H2,20,24)(H,21,22).

What are the key properties of 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol?

5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol has a molecular weight of 1933.07 g/mol, XLogP of 21.05, 20 rotatable bonds, 9 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[1-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]-1H-pyrimidine-2,4-dione;1,1,1,3,3,3-hexafluoro-2-[4-[[5-(6-methyl-2-pyridinyl)-2,3-dihydroindol-1-yl]methyl]phenyl]propan-2-ol;1-[(4-propan-2-ylphenyl)methyl]-5-(1H-pyrazol-4-yl)-2,3-dihydroindole;4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]benzamide;1-[4-[[5-(1H-pyrazol-4-yl)-2,3-dihydroindol-1-yl]methyl]phenyl]cyclobutan-1-ol is sourced from PubChem (CID 160688018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).