bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one

C88H105F3N10O8S — CID 157477880

IUPACbis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one
SMILESCC(C)N1C(=O)Cc2ccccc21.CC(C)N1C(=O)Cc2cccnc21.CC(C)N1C(=O)Cc2ccsc21.CC(C)N1C(=O)Cc2ncccc21.Cc1c(F)ccc2c1N(C(C)C)C(=O)C2.Cc1c(F)ccc2c1N(C(C)C)C(=O)C2.Cc1ccc2c(c1)N(C(C)C)C(=O)C2.Cc1ccc2c(c1F)N(C(C)C)C(=O)C2
InChIInChI=1S/3C12H14FNO.C12H15NO.C11H13NO.2C10H12N2O.C9H11NOS/c2*1-7(2)14-11(15)6-9-4-5-10(13)8(3)12(9)14;1-7(2)14-10(15)6-9-5-4-8(3)11(13)12(9)14;1-8(2)13-11-6-9(3)4-5-10(11)7-12(13)14;1-8(2)12-10-6-4-3-5-9(10)7-11(12)13;1-7(2)12-9-4-3-5-11-8(9)6-10(12)13;1-7(2)12-9(13)6-8-4-3-5-11-10(8)12;1-6(2)10-8(11)5-7-3-4-12-9(7)10/h3*4-5,7H,6H2,1-3H3;4-6,8H,7H2,1-3H3;3-6,8H,7H2,1-2H3;2*3-5,7H,6H2,1-2H3;3-4,6H,5H2,1-2H3
InChIKeyBVURDCCASSUAOD-UHFFFAOYSA-N
MW1519.93 g/mol
LogP16.38
Rot. Bonds8

About bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one

bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one (PubChem CID 157477880) has the molecular formula C88H105F3N10O8S and a molecular weight of 1519.93 g/mol. Its IUPAC name is bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one.

Molecular Properties

Compound Namebis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one
PubChem CID157477880
Molecular FormulaC88H105F3N10O8S
Molecular Weight1519.93 g/mol
Exact Mass1518.78
IUPAC Namebis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one
SMILESCC(C)N1C(=O)Cc2ccccc21.CC(C)N1C(=O)Cc2cccnc21.CC(C)N1C(=O)Cc2ccsc21.CC(C)N1C(=O)Cc2ncccc21.Cc1c(F)ccc2c1N(C(C)C)C(=O)C2.Cc1c(F)ccc2c1N(C(C)C)C(=O)C2.Cc1ccc2c(c1)N(C(C)C)C(=O)C2.Cc1ccc2c(c1F)N(C(C)C)C(=O)C2
InChIInChI=1S/3C12H14FNO.C12H15NO.C11H13NO.2C10H12N2O.C9H11NOS/c2*1-7(2)14-11(15)6-9-4-5-10(13)8(3)12(9)14;1-7(2)14-10(15)6-9-5-4-8(3)11(13)12(9)14;1-8(2)13-11-6-9(3)4-5-10(11)7-12(13)14;1-8(2)12-10-6-4-3-5-9(10)7-11(12)13;1-7(2)12-9-4-3-5-11-8(9)6-10(12)13;1-7(2)12-9(13)6-8-4-3-5-11-10(8)12;1-6(2)10-8(11)5-7-3-4-12-9(7)10/h3*4-5,7H,6H2,1-3H3;4-6,8H,7H2,1-3H3;3-6,8H,7H2,1-2H3;2*3-5,7H,6H2,1-2H3;3-4,6H,5H2,1-2H3
InChIKeyBVURDCCASSUAOD-UHFFFAOYSA-N
XLogP16.38
TPSA188.26 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds8
Heavy Atoms110
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001519.93
LogP ≤ 516.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one?
The IUPAC name of bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one (CID 157477880) is bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one.
What is the SMILES notation for bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one?
The canonical SMILES for bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one is CC(C)N1C(=O)Cc2ccccc21.CC(C)N1C(=O)Cc2cccnc21.CC(C)N1C(=O)Cc2ccsc21.CC(C)N1C(=O)Cc2ncccc21.Cc1c(F)ccc2c1N(C(C)C)C(=O)C2.Cc1c(F)ccc2c1N(C(C)C)C(=O)C2.Cc1ccc2c(c1)N(C(C)C)C(=O)C2.Cc1ccc2c(c1F)N(C(C)C)C(=O)C2.
What is the InChIKey of bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one?
The InChIKey is BVURDCCASSUAOD-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H14FNO.C12H15NO.C11H13NO.2C10H12N2O.C9H11NOS/c2*1-7(2)14-11(15)6-9-4-5-10(13)8(3)12(9)14;1-7(2)14-10(15)6-9-5-4-8(3)11(13)12(9)14;1-8(2)13-11-6-9(3)4-5-10(11)7-12(13)14;1-8(2)12-10-6-4-3-5-9(10)7-11(12)13;1-7(2)12-9-4-3-5-11-8(9)6-10(12)13;1-7(2)12-9(13)6-8-4-3-5-11-10(8)12;1-6(2)10-8(11)5-7-3-4-12-9(7)10/h3*4-5,7H,6H2,1-3H3;4-6,8H,7H2,1-3H3;3-6,8H,7H2,1-2H3;2*3-5,7H,6H2,1-2H3;3-4,6H,5H2,1-2H3.
What are the key properties of bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one?
bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one has a molecular weight of 1519.93 g/mol, XLogP of 16.38, 8 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for bis(6-fluoro-7-methyl-1-propan-2-yl-3H-indol-2-one);7-fluoro-6-methyl-1-propan-2-yl-3H-indol-2-one;6-methyl-1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-indol-2-one;1-propan-2-yl-3H-pyrrolo[2,3-b]pyridin-2-one;1-propan-2-yl-3H-pyrrolo[3,2-b]pyridin-2-one;6-propan-2-yl-4H-thieno[2,3-b]pyrrol-5-one is sourced from PubChem (CID 157477880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).