N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine

C182H241FN22O9S — CID 158920438

About N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine

N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine (PubChem CID 158920438) has the molecular formula C182H241FN22O9S and a molecular weight of 2932.14 g/mol. Its IUPAC name is N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine.

Molecular Properties

• Compound Name: N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine
• PubChem CID: 158920438
• Molecular Formula: C182H241FN22O9S
• Molecular Weight: 2932.14 g/mol
• Exact Mass: 2929.88
• IUPAC Name: N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine
• SMILES: CC(=O)Nc1ccccc1/C=C/C(C)C.CC(C)(C)OC(=O)n1cc(C(C)(C)C)c2ccccc21.CC(C)(C)c1cc2ccccc2n1S(=O)(=O)c1ccc(F)cc1.CC(C)(C)c1cccc(C(=O)NC2CC2)c1.CC(C)C(=O)Cc1cccc(-c2nncn2C)c1.CC(C)C(=O)NC(c1ccccc1)c1ccccc1.CC(C)c1ccc(N2CCCCC2)cc1.CC(C)c1ccc2cc[nH]c2c1.CC(C)c1cccc2nn(C)cc12.CC(C)c1cnc(N)c(OCC2CC2)c1.CC(C)c1cnn(C(C)C)c1.CCn1cc(C(C)C)cn1.Cc1c(C(C)C)ccc2nn(C)cc12.Cc1cc2nn(C)cc2cc1C(C)C
• InChI: InChI=1S/C18H18FNO2S.C17H23NO2.C17H19NO.C14H17N3O.C14H19NO.C14H21N.C13H17NO.C12H18N2O.2C12H16N2.C11H14N2.C11H13N.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;1-16(2,3)13-11-18(15(19)20-17(4,5)6)14-10-8-7-9-12(13)14;1-13(2)17(19)18-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15;1-10(2)13(18)8-11-5-4-6-12(7-11)14-16-15-9-17(14)3;1-14(2,3)11-6-4-5-10(9-11)13(16)15-12-7-8-12;1-12(2)13-6-8-14(9-7-13)15-10-4-3-5-11-15;1-10(2)8-9-12-6-4-5-7-13(12)14-11(3)15;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)10-5-6-12-11(9(10)3)7-14(4)13-12;1-8(2)9-5-4-6-11-10(9)7-13(3)12-11;1-8(2)10-4-3-9-5-6-12-11(9)7-10;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;7-11H,1-6H3;3-13,16H,1-2H3,(H,18,19);4-7,9-10H,8H2,1-3H3;4-6,9,12H,7-8H2,1-3H3,(H,15,16);6-9,12H,3-5,10-11H2,1-2H3;4-10H,1-3H3,(H,14,15);5-6,8-9H,3-4,7H2,1-2H3,(H2,13,14);2*5-8H,1-4H3;4-8H,1-3H3;3-8,12H,1-2H3;5-8H,1-4H3;5-7H,4H2,1-3H3/b;;;;;;9-8+
• InChIKey: JHTRFCFFPWFCTO-MWLLSFMRSA-N
• XLogP: 44.01
• TPSA: 361.65 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 29
• Heavy Atoms: 215
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2932.14
LogP ≤ 5	44.01
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine?

The IUPAC name of N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine (CID 158920438) is N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine.

What is the SMILES notation for N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine?

The canonical SMILES for N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine is CC(=O)Nc1ccccc1/C=C/C(C)C.CC(C)(C)OC(=O)n1cc(C(C)(C)C)c2ccccc21.CC(C)(C)c1cc2ccccc2n1S(=O)(=O)c1ccc(F)cc1.CC(C)(C)c1cccc(C(=O)NC2CC2)c1.CC(C)C(=O)Cc1cccc(-c2nncn2C)c1.CC(C)C(=O)NC(c1ccccc1)c1ccccc1.CC(C)c1ccc(N2CCCCC2)cc1.CC(C)c1ccc2cc[nH]c2c1.CC(C)c1cccc2nn(C)cc12.CC(C)c1cnc(N)c(OCC2CC2)c1.CC(C)c1cnn(C(C)C)c1.CCn1cc(C(C)C)cn1.Cc1c(C(C)C)ccc2nn(C)cc12.Cc1cc2nn(C)cc2cc1C(C)C.

What is the InChIKey of N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine?

The InChIKey is JHTRFCFFPWFCTO-MWLLSFMRSA-N. The full InChI is InChI=1S/C18H18FNO2S.C17H23NO2.C17H19NO.C14H17N3O.C14H19NO.C14H21N.C13H17NO.C12H18N2O.2C12H16N2.C11H14N2.C11H13N.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;1-16(2,3)13-11-18(15(19)20-17(4,5)6)14-10-8-7-9-12(13)14;1-13(2)17(19)18-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15;1-10(2)13(18)8-11-5-4-6-12(7-11)14-16-15-9-17(14)3;1-14(2,3)11-6-4-5-10(9-11)13(16)15-12-7-8-12;1-12(2)13-6-8-14(9-7-13)15-10-4-3-5-11-15;1-10(2)8-9-12-6-4-5-7-13(12)14-11(3)15;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)10-5-6-12-11(9(10)3)7-14(4)13-12;1-8(2)9-5-4-6-11-10(9)7-13(3)12-11;1-8(2)10-4-3-9-5-6-12-11(9)7-10;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;7-11H,1-6H3;3-13,16H,1-2H3,(H,18,19);4-7,9-10H,8H2,1-3H3;4-6,9,12H,7-8H2,1-3H3,(H,15,16);6-9,12H,3-5,10-11H2,1-2H3;4-10H,1-3H3,(H,14,15);5-6,8-9H,3-4,7H2,1-2H3,(H2,13,14);2*5-8H,1-4H3;4-8H,1-3H3;3-8,12H,1-2H3;5-8H,1-4H3;5-7H,4H2,1-3H3/b;;;;;;9-8+;;;;;;;.

What are the key properties of N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine?

N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine has a molecular weight of 2932.14 g/mol, XLogP of 44.01, 29 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N-benzhydryl-2-methylpropanamide;tert-butyl 3-tert-butylindole-1-carboxylate;3-tert-butyl-N-cyclopropylbenzamide;2-tert-butyl-1-(4-fluorophenyl)sulfonylindole;3-(cyclopropylmethoxy)-5-propan-2-ylpyridin-2-amine;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;N-[2-[(E)-3-methylbut-1-enyl]phenyl]acetamide;3-methyl-1-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]butan-2-one;2-methyl-4-propan-2-ylindazole;6-propan-2-yl-1H-indole;1-(4-propan-2-ylphenyl)piperidine is sourced from PubChem (CID 158920438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).