4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one

C200H233N39O6 — CID 159504570

IUPAC4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one
SMILESCC(=O)N1CCc2c(C(C)C)cccc21.CC(C)c1cc2cncnc2cn1.CC(C)c1ccc2[nH]c(=O)cnc2c1.CC(C)c1ccc2[nH]c(=O)ncc2c1.CC(C)c1ccc2c(c1)CCC(=O)N2.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cncnc2c1.CC(C)c1ccc2nccnc2c1.CC(C)c1ccc2nccnc2n1.CC(C)c1cccc2[nH]c(=O)[nH]c12.CC(C)c1cccc2[nH]ccc12.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2[nH]ncc12.CC(C)c1cccc2c1CC(=O)N2.CC(C)c1cccc2cn[nH]c12.CC(C)c1cccc2n[nH]nc12.CC(C)c1ccnc2[nH]ncc12.CC(C)c1cnc2ncccc2c1.CC(C)c1ncnc2[nH]ncc12
InChIInChI=1S/C13H17NO.C12H15NO.C12H13N.2C11H12N2O.3C11H12N2.C11H13NO.C11H13N.2C10H11N3.C10H12N2O.3C10H12N2.2C9H11N3.C8H10N4/c1-9(2)11-5-4-6-13-12(11)7-8-14(13)10(3)15;1-8(2)9-3-5-11-10(7-9)4-6-12(14)13-11;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;1-7(2)8-3-4-10-9(5-8)6-12-11(14)13-10;1-7(2)8-3-4-9-10(5-8)12-6-11(14)13-9;1-8(2)9-3-4-10-6-12-7-13-11(10)5-9;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;1-8(2)10-6-9-4-3-5-12-11(9)13-7-10;1-7(2)8-4-3-5-10-9(8)6-11(13)12-10;1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-7(2)9-3-8-4-11-6-13-10(8)5-12-9;1-7(2)8-3-4-9-10(13-8)12-6-5-11-9;1-6(2)7-4-3-5-8-9(7)12-10(13)11-8;1-7(2)8-4-3-5-10-9(8)6-11-12-10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)9-5-3-4-8-6-11-12-10(8)9;1-6(2)7-3-4-10-9-8(7)5-11-12-9;1-6(2)7-4-3-5-8-9(7)11-12-10-8;1-5(2)7-6-3-11-12-8(6)10-4-9-7/h4-6,9H,7-8H2,1-3H3;3,5,7-8H,4,6H2,1-2H3,(H,13,14);3-9H,1-2H3;3-7H,1-2H3,(H,12,13,14);3-7H,1-2H3,(H,13,14);3*3-8H,1-2H3;3-5,7H,6H2,1-2H3,(H,12,13);3-8,12H,1-2H3;2*3-7H,1-2H3;3-6H,1-2H3,(H2,11,12,13);3*3-7H,1-2H3,(H,11,12);2*3-6H,1-2H3,(H,10,11,12);3-5H,1-2H3,(H,9,10,11,12)
InChIKeyLZUXEGFAVHEQBP-UHFFFAOYSA-N
MW3279.33 g/mol
LogP46.69
Rot. Bonds19

About 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one

4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one (PubChem CID 159504570) has the molecular formula C200H233N39O6 and a molecular weight of 3279.33 g/mol. Its IUPAC name is 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one.

Molecular Properties

Compound Name4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one
PubChem CID159504570
Molecular FormulaC200H233N39O6
Molecular Weight3279.33 g/mol
Exact Mass3276.91
IUPAC Name4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one
SMILESCC(=O)N1CCc2c(C(C)C)cccc21.CC(C)c1cc2cncnc2cn1.CC(C)c1ccc2[nH]c(=O)cnc2c1.CC(C)c1ccc2[nH]c(=O)ncc2c1.CC(C)c1ccc2c(c1)CCC(=O)N2.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cncnc2c1.CC(C)c1ccc2nccnc2c1.CC(C)c1ccc2nccnc2n1.CC(C)c1cccc2[nH]c(=O)[nH]c12.CC(C)c1cccc2[nH]ccc12.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2[nH]ncc12.CC(C)c1cccc2c1CC(=O)N2.CC(C)c1cccc2cn[nH]c12.CC(C)c1cccc2n[nH]nc12.CC(C)c1ccnc2[nH]ncc12.CC(C)c1cnc2ncccc2c1.CC(C)c1ncnc2[nH]ncc12
InChIInChI=1S/C13H17NO.C12H15NO.C12H13N.2C11H12N2O.3C11H12N2.C11H13NO.C11H13N.2C10H11N3.C10H12N2O.3C10H12N2.2C9H11N3.C8H10N4/c1-9(2)11-5-4-6-13-12(11)7-8-14(13)10(3)15;1-8(2)9-3-5-11-10(7-9)4-6-12(14)13-11;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;1-7(2)8-3-4-10-9(5-8)6-12-11(14)13-10;1-7(2)8-3-4-9-10(5-8)12-6-11(14)13-9;1-8(2)9-3-4-10-6-12-7-13-11(10)5-9;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;1-8(2)10-6-9-4-3-5-12-11(9)13-7-10;1-7(2)8-4-3-5-10-9(8)6-11(13)12-10;1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-7(2)9-3-8-4-11-6-13-10(8)5-12-9;1-7(2)8-3-4-9-10(13-8)12-6-5-11-9;1-6(2)7-4-3-5-8-9(7)12-10(13)11-8;1-7(2)8-4-3-5-10-9(8)6-11-12-10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)9-5-3-4-8-6-11-12-10(8)9;1-6(2)7-3-4-10-9-8(7)5-11-12-9;1-6(2)7-4-3-5-8-9(7)11-12-10-8;1-5(2)7-6-3-11-12-8(6)10-4-9-7/h4-6,9H,7-8H2,1-3H3;3,5,7-8H,4,6H2,1-2H3,(H,13,14);3-9H,1-2H3;3-7H,1-2H3,(H,12,13,14);3-7H,1-2H3,(H,13,14);3*3-8H,1-2H3;3-5,7H,6H2,1-2H3,(H,12,13);3-8,12H,1-2H3;2*3-7H,1-2H3;3-6H,1-2H3,(H2,11,12,13);3*3-7H,1-2H3,(H,11,12);2*3-6H,1-2H3,(H,10,11,12);3-5H,1-2H3,(H,9,10,11,12)
InChIKeyLZUXEGFAVHEQBP-UHFFFAOYSA-N
XLogP46.69
TPSA625.66 Ų
H-Bond Donors13
H-Bond Acceptors31
Rotatable Bonds19
Heavy Atoms245
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003279.33
LogP ≤ 546.69
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1031

Analyze 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one with MolForge

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Launch Full Analysis

Related Compounds

2-(5-isoquinolin-4-yl-1H-pyrazolo[5,4-b]pyridin-3-yl)-N-(2-methylphenyl)-3H-benzimidazole-5-carboxamide
CID 136068703
US20240025884, Example 426
CID 170672791
US20240025884, Example 423
CID 170672808
US20240025884, Example 408
CID 170672975
US20240025884, Example 411
CID 170673034
US20240025884, Example 386
CID 170673057
US20240025884, Example 430
CID 170673203
US20240025884, Example 424
CID 170673257
US20240025884, Example 448
CID 170673292
US20240025884, Example 450
CID 170715296
US20240025884, Example 449
CID 170715351
US20240025884, Example 457
CID 171034517

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one?
The IUPAC name of 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one (CID 159504570) is 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one.
What is the SMILES notation for 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one?
The canonical SMILES for 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one is CC(=O)N1CCc2c(C(C)C)cccc21.CC(C)c1cc2cncnc2cn1.CC(C)c1ccc2[nH]c(=O)cnc2c1.CC(C)c1ccc2[nH]c(=O)ncc2c1.CC(C)c1ccc2c(c1)CCC(=O)N2.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cncnc2c1.CC(C)c1ccc2nccnc2c1.CC(C)c1ccc2nccnc2n1.CC(C)c1cccc2[nH]c(=O)[nH]c12.CC(C)c1cccc2[nH]ccc12.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2[nH]ncc12.CC(C)c1cccc2c1CC(=O)N2.CC(C)c1cccc2cn[nH]c12.CC(C)c1cccc2n[nH]nc12.CC(C)c1ccnc2[nH]ncc12.CC(C)c1cnc2ncccc2c1.CC(C)c1ncnc2[nH]ncc12.
What is the InChIKey of 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one?
The InChIKey is LZUXEGFAVHEQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO.C12H15NO.C12H13N.2C11H12N2O.3C11H12N2.C11H13NO.C11H13N.2C10H11N3.C10H12N2O.3C10H12N2.2C9H11N3.C8H10N4/c1-9(2)11-5-4-6-13-12(11)7-8-14(13)10(3)15;1-8(2)9-3-5-11-10(7-9)4-6-12(14)13-11;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;1-7(2)8-3-4-10-9(5-8)6-12-11(14)13-10;1-7(2)8-3-4-9-10(5-8)12-6-11(14)13-9;1-8(2)9-3-4-10-6-12-7-13-11(10)5-9;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;1-8(2)10-6-9-4-3-5-12-11(9)13-7-10;1-7(2)8-4-3-5-10-9(8)6-11(13)12-10;1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-7(2)9-3-8-4-11-6-13-10(8)5-12-9;1-7(2)8-3-4-9-10(13-8)12-6-5-11-9;1-6(2)7-4-3-5-8-9(7)12-10(13)11-8;1-7(2)8-4-3-5-10-9(8)6-11-12-10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)9-5-3-4-8-6-11-12-10(8)9;1-6(2)7-3-4-10-9-8(7)5-11-12-9;1-6(2)7-4-3-5-8-9(7)11-12-10-8;1-5(2)7-6-3-11-12-8(6)10-4-9-7/h4-6,9H,7-8H2,1-3H3;3,5,7-8H,4,6H2,1-2H3,(H,13,14);3-9H,1-2H3;3-7H,1-2H3,(H,12,13,14);3-7H,1-2H3,(H,13,14);3*3-8H,1-2H3;3-5,7H,6H2,1-2H3,(H,12,13);3-8,12H,1-2H3;2*3-7H,1-2H3;3-6H,1-2H3,(H2,11,12,13);3*3-7H,1-2H3,(H,11,12);2*3-6H,1-2H3,(H,10,11,12);3-5H,1-2H3,(H,9,10,11,12).
What are the key properties of 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one?
4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one has a molecular weight of 3279.33 g/mol, XLogP of 46.69, 19 rotatable bonds, 13 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-2H-benzotriazole;4-propan-2-yl-1,3-dihydrobenzimidazol-2-one;4-propan-2-yl-1,3-dihydroindol-2-one;1-(4-propan-2-yl-2,3-dihydroindol-1-yl)ethanone;6-propan-2-yl-3,4-dihydro-1H-quinolin-2-one;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indazole;4-propan-2-yl-1H-indole;3-propan-2-yl-1,8-naphthyridine;4-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;4-propan-2-yl-1H-pyrazolo[3,4-d]pyrimidine;6-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylpyrido[3,4-d]pyrimidine;7-propan-2-ylquinazoline;6-propan-2-yl-1H-quinazolin-2-one;7-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1H-quinoxalin-2-one is sourced from PubChem (CID 159504570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).