5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine

C147H201FN18O5S — CID 158608433

About 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine

5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine (PubChem CID 158608433) has the molecular formula C147H201FN18O5S and a molecular weight of 2351.41 g/mol. Its IUPAC name is 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine.

Molecular Properties

• Compound Name: 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine
• PubChem CID: 158608433
• Molecular Formula: C147H201FN18O5S
• Molecular Weight: 2351.41 g/mol
• Exact Mass: 2349.57
• IUPAC Name: 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine
• SMILES: CC(C)(C)c1cc2ccccc2n1S(=O)(=O)c1ccc(F)cc1.CC(C)(C)c1ccc2c(c1)CC(=O)N2.CC(C)c1ccc(N2CCCCC2)cc1.CC(C)c1ccc2c(c1)CC(=O)N2C.CC(C)c1cnc(N)c(OCC2CC2)c1.CC(C)c1cnn(C(C)C)c1.CCn1cc(C(C)C)cn1.CN1CCc2cc(C(C)(C)C)ccc21.Cc1c(C(C)(C)C)[nH]c2ccccc12.Cc1c(C(C)C)ccc2nn(C)cc12.Cc1cc2c(cnn2C)cc1C(C)C.Cc1cc2nn(C)cc2cc1C(C)C
• InChI: InChI=1S/C18H18FNO2S.C14H21N.C13H19N.C13H17N.C12H18N2O.3C12H16N2.2C12H15NO.C9H16N2.C8H14N2/c1-18(2,3)17-12-13-6-4-5-7-16(13)20(17)23(21,22)15-10-8-14(19)9-11-15;1-12(2)13-6-8-14(9-7-13)15-10-4-3-5-11-15;1-13(2,3)11-5-6-12-10(9-11)7-8-14(12)4;1-9-10-7-5-6-8-11(10)14-12(9)13(2,3)4;1-8(2)10-5-11(12(13)14-6-10)15-7-9-3-4-9;1-8(2)11-6-10-7-14(4)13-12(10)5-9(11)3;1-8(2)11-6-10-7-13-14(4)12(10)5-9(11)3;1-8(2)10-5-6-12-11(9(10)3)7-14(4)13-12;1-12(2,3)9-4-5-10-8(6-9)7-11(14)13-10;1-8(2)9-4-5-11-10(6-9)7-12(14)13(11)3;1-7(2)9-5-10-11(6-9)8(3)4;1-4-10-6-8(5-9-10)7(2)3/h4-12H,1-3H3;6-9,12H,3-5,10-11H2,1-2H3;5-6,9H,7-8H2,1-4H3;5-8,14H,1-4H3;5-6,8-9H,3-4,7H2,1-2H3,(H2,13,14);3*5-8H,1-4H3;4-6H,7H2,1-3H3,(H,13,14);4-6,8H,7H2,1-3H3;5-8H,1-4H3;5-7H,4H2,1-3H3
• InChIKey: HWNIVJSKBYBSEY-UHFFFAOYSA-N
• XLogP: 35.88
• TPSA: 247.99 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 20
• Rotatable Bonds: 16
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2351.41
LogP ≤ 5	35.88
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine?

The IUPAC name of 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine (CID 158608433) is 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine.

What is the SMILES notation for 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine?

The canonical SMILES for 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine is CC(C)(C)c1cc2ccccc2n1S(=O)(=O)c1ccc(F)cc1.CC(C)(C)c1ccc2c(c1)CC(=O)N2.CC(C)c1ccc(N2CCCCC2)cc1.CC(C)c1ccc2c(c1)CC(=O)N2C.CC(C)c1cnc(N)c(OCC2CC2)c1.CC(C)c1cnn(C(C)C)c1.CCn1cc(C(C)C)cn1.CN1CCc2cc(C(C)(C)C)ccc21.Cc1c(C(C)(C)C)[nH]c2ccccc12.Cc1c(C(C)C)ccc2nn(C)cc12.Cc1cc2c(cnn2C)cc1C(C)C.Cc1cc2nn(C)cc2cc1C(C)C.

What is the InChIKey of 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine?

The InChIKey is HWNIVJSKBYBSEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FNO2S.C14H21N.C13H19N.C13H17N.C12H18N2O.3C12H16N2.2C12H15NO.C9H16N2.C8H14N2/c1-18(2,3)17-12-13-6-4-5-7-16(13)20(17)23(21,22)15-10-8-14(19)9-11-15;1-12(2)13-6-8-14(9-7-13)15-10-4-3-5-11-15;1-13(2,3)11-5-6-12-10(9-11)7-8-14(12)4;1-9-10-7-5-6-8-11(10)14-12(9)13(2,3)4;1-8(2)10-5-11(12(13)14-6-10)15-7-9-3-4-9;1-8(2)11-6-10-7-14(4)13-12(10)5-9(11)3;1-8(2)11-6-10-7-13-14(4)12(10)5-9(11)3;1-8(2)10-5-6-12-11(9(10)3)7-14(4)13-12;1-12(2,3)9-4-5-10-8(6-9)7-11(14)13-10;1-8(2)9-4-5-11-10(6-9)7-12(14)13(11)3;1-7(2)9-5-10-11(6-9)8(3)4;1-4-10-6-8(5-9-10)7(2)3/h4-12H,1-3H3;6-9,12H,3-5,10-11H2,1-2H3;5-6,9H,7-8H2,1-4H3;5-8,14H,1-4H3;5-6,8-9H,3-4,7H2,1-2H3,(H2,13,14);3*5-8H,1-4H3;4-6H,7H2,1-3H3,(H,13,14);4-6,8H,7H2,1-3H3;5-8H,1-4H3;5-7H,4H2,1-3H3.

What are the key properties of 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine?

5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine has a molecular weight of 2351.41 g/mol, XLogP of 35.88, 16 rotatable bonds, 3 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 5-tert-butyl-1,3-dihydroindol-2-one;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;5-tert-butyl-1-methyl-2,3-dihydroindole;2-tert-butyl-3-methyl-1H-indole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;1,6-dimethyl-5-propan-2-ylindazole;2,4-dimethyl-5-propan-2-ylindazole;2,6-dimethyl-5-propan-2-ylindazole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-yl-3H-indol-2-one;1-(4-propan-2-ylphenyl)piperidine is sourced from PubChem (CID 158608433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).