3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one

C165H191N27O10S2 — CID 162030544

IUPAC3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one
SMILESCC(C)c1cc2ccc(C#N)cc2[nH]1.CC(C)c1ccc(-c2ccn[nH]2)cc1.CC(C)c1ccc(-n2ccnc2)c(N)c1.CC(C)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1.CC(C)c1ccc2[nH]c(=O)ccc2c1.CC(C)c1ccc2c(c1)CC(=O)C(=O)N2.CC(C)c1ccc2c(c1)CC(=O)CS2.CC(C)c1ccc2cccc(O)c2n1.CC(C)c1ccc2nc(N)[nH]c2c1.CCc1noc(-c2ccc(C(C)C)cc2)n1.Cc1nc(-c2ccc(C(C)C)cc2)no1.Cc1nc(-c2cccc(C(C)C)c2)no1.Cc1nc(-c2cnccn2)sc1C(C)C.Cc1nc2ccc(C(C)C)cc2[nH]1
InChIInChI=1S/C13H16N2O.C12H13N3O2.C12H15N3.2C12H14N2O.C12H14N2.C12H12N2.C12H13NO2.2C12H13NO.C12H14OS.C11H13N3S.C11H14N2.C10H13N3/c1-4-12-14-13(16-15-12)11-7-5-10(6-8-11)9(2)3;1-9(2)10-3-4-11(12(7-10)15(16)17)14-6-5-13-8-14;1-9(2)10-3-4-12(11(13)7-10)15-6-5-14-8-15;1-8(2)10-4-6-11(7-5-10)12-13-9(3)15-14-12;1-8(2)10-5-4-6-11(7-10)12-13-9(3)15-14-12;1-9(2)10-3-5-11(6-4-10)12-7-8-13-14-12;1-8(2)11-6-10-4-3-9(7-13)5-12(10)14-11;1-7(2)8-3-4-10-9(5-8)6-11(14)12(15)13-10;1-8(2)9-3-5-11-10(7-9)4-6-12(14)13-11;1-8(2)10-7-6-9-4-3-5-11(14)12(9)13-10;1-8(2)9-3-4-12-10(5-9)6-11(13)7-14-12;1-7(2)10-8(3)14-11(15-10)9-6-12-4-5-13-9;1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-6(2)7-3-4-8-9(5-7)13-10(11)12-8/h5-9H,4H2,1-3H3;3-9H,1-2H3;3-9H,13H2,1-2H3;2*4-8H,1-3H3;3-9H,1-2H3,(H,13,14);3-6,8,14H,1-2H3;3-5,7H,6H2,1-2H3,(H,13,15);3-8H,1-2H3,(H,13,14);3-8,14H,1-2H3;3-5,8H,6-7H2,1-2H3;4-7H,1-3H3;4-7H,1-3H3,(H,12,13);3-6H,1-2H3,(H3,11,12,13)
InChIKeyYVYRLXXKAFBJKA-UHFFFAOYSA-N
MW2776.66 g/mol
LogP40.52
Rot. Bonds23

About 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one

3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one (PubChem CID 162030544) has the molecular formula C165H191N27O10S2 and a molecular weight of 2776.66 g/mol. Its IUPAC name is 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one.

Molecular Properties

Compound Name3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one
PubChem CID162030544
Molecular FormulaC165H191N27O10S2
Molecular Weight2776.66 g/mol
Exact Mass2774.47
IUPAC Name3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one
SMILESCC(C)c1cc2ccc(C#N)cc2[nH]1.CC(C)c1ccc(-c2ccn[nH]2)cc1.CC(C)c1ccc(-n2ccnc2)c(N)c1.CC(C)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1.CC(C)c1ccc2[nH]c(=O)ccc2c1.CC(C)c1ccc2c(c1)CC(=O)C(=O)N2.CC(C)c1ccc2c(c1)CC(=O)CS2.CC(C)c1ccc2cccc(O)c2n1.CC(C)c1ccc2nc(N)[nH]c2c1.CCc1noc(-c2ccc(C(C)C)cc2)n1.Cc1nc(-c2ccc(C(C)C)cc2)no1.Cc1nc(-c2cccc(C(C)C)c2)no1.Cc1nc(-c2cnccn2)sc1C(C)C.Cc1nc2ccc(C(C)C)cc2[nH]1
InChIInChI=1S/C13H16N2O.C12H13N3O2.C12H15N3.2C12H14N2O.C12H14N2.C12H12N2.C12H13NO2.2C12H13NO.C12H14OS.C11H13N3S.C11H14N2.C10H13N3/c1-4-12-14-13(16-15-12)11-7-5-10(6-8-11)9(2)3;1-9(2)10-3-4-11(12(7-10)15(16)17)14-6-5-13-8-14;1-9(2)10-3-4-12(11(13)7-10)15-6-5-14-8-15;1-8(2)10-4-6-11(7-5-10)12-13-9(3)15-14-12;1-8(2)10-5-4-6-11(7-10)12-13-9(3)15-14-12;1-9(2)10-3-5-11(6-4-10)12-7-8-13-14-12;1-8(2)11-6-10-4-3-9(7-13)5-12(10)14-11;1-7(2)8-3-4-10-9(5-8)6-11(14)12(15)13-10;1-8(2)9-3-5-11-10(7-9)4-6-12(14)13-11;1-8(2)10-7-6-9-4-3-5-11(14)12(9)13-10;1-8(2)9-3-4-12-10(5-9)6-11(13)7-14-12;1-7(2)10-8(3)14-11(15-10)9-6-12-4-5-13-9;1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-6(2)7-3-4-8-9(5-7)13-10(11)12-8/h5-9H,4H2,1-3H3;3-9H,1-2H3;3-9H,13H2,1-2H3;2*4-8H,1-3H3;3-9H,1-2H3,(H,13,14);3-6,8,14H,1-2H3;3-5,7H,6H2,1-2H3,(H,13,15);3-8H,1-2H3,(H,13,14);3-8,14H,1-2H3;3-5,8H,6-7H2,1-2H3;4-7H,1-3H3;4-7H,1-3H3,(H,12,13);3-6H,1-2H3,(H3,11,12,13)
InChIKeyYVYRLXXKAFBJKA-UHFFFAOYSA-N
XLogP40.52
TPSA541.09 Ų
H-Bond Donors9
H-Bond Acceptors32
Rotatable Bonds23
Heavy Atoms204
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002776.66
LogP ≤ 540.52
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one with MolForge

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Related Compounds

CID 157886358
CID 157886358
3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol
CID 159145664
1,5-dimethyl-4-(5-propan-2-yl-1H-pyrazol-3-yl)pyrazole;1-ethyl-3-methyl-6-propan-2-ylquinoxalin-2-one;2-methyl-6-propan-2-yl-1H-benzimidazole;5-(1-methylpyrazol-4-yl)-3-propan-2-yl-1,2-oxazole;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-ylimidazo[1,2-a]pyridine-6-carbonitrile;2-propan-2-ylimidazo[1,2-a]pyridine-7-carboxamide;2-propan-2-ylimidazo[1,2-a]pyridine-8-carboxamide;2-propan-2-yl-1H-indole-6-carbonitrile;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one;5-(5-propan-2-ylthiophen-2-yl)pyridin-2-amine;3-(5-propan-2-ylthiophen-2-yl)pyridine
CID 159268423

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one?
The IUPAC name of 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one (CID 162030544) is 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one.
What is the SMILES notation for 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one?
The canonical SMILES for 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one is CC(C)c1cc2ccc(C#N)cc2[nH]1.CC(C)c1ccc(-c2ccn[nH]2)cc1.CC(C)c1ccc(-n2ccnc2)c(N)c1.CC(C)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1.CC(C)c1ccc2[nH]c(=O)ccc2c1.CC(C)c1ccc2c(c1)CC(=O)C(=O)N2.CC(C)c1ccc2c(c1)CC(=O)CS2.CC(C)c1ccc2cccc(O)c2n1.CC(C)c1ccc2nc(N)[nH]c2c1.CCc1noc(-c2ccc(C(C)C)cc2)n1.Cc1nc(-c2ccc(C(C)C)cc2)no1.Cc1nc(-c2cccc(C(C)C)c2)no1.Cc1nc(-c2cnccn2)sc1C(C)C.Cc1nc2ccc(C(C)C)cc2[nH]1.
What is the InChIKey of 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one?
The InChIKey is YVYRLXXKAFBJKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O.C12H13N3O2.C12H15N3.2C12H14N2O.C12H14N2.C12H12N2.C12H13NO2.2C12H13NO.C12H14OS.C11H13N3S.C11H14N2.C10H13N3/c1-4-12-14-13(16-15-12)11-7-5-10(6-8-11)9(2)3;1-9(2)10-3-4-11(12(7-10)15(16)17)14-6-5-13-8-14;1-9(2)10-3-4-12(11(13)7-10)15-6-5-14-8-15;1-8(2)10-4-6-11(7-5-10)12-13-9(3)15-14-12;1-8(2)10-5-4-6-11(7-10)12-13-9(3)15-14-12;1-9(2)10-3-5-11(6-4-10)12-7-8-13-14-12;1-8(2)11-6-10-4-3-9(7-13)5-12(10)14-11;1-7(2)8-3-4-10-9(5-8)6-11(14)12(15)13-10;1-8(2)9-3-5-11-10(7-9)4-6-12(14)13-11;1-8(2)10-7-6-9-4-3-5-11(14)12(9)13-10;1-8(2)9-3-4-12-10(5-9)6-11(13)7-14-12;1-7(2)10-8(3)14-11(15-10)9-6-12-4-5-13-9;1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-6(2)7-3-4-8-9(5-7)13-10(11)12-8/h5-9H,4H2,1-3H3;3-9H,1-2H3;3-9H,13H2,1-2H3;2*4-8H,1-3H3;3-9H,1-2H3,(H,13,14);3-6,8,14H,1-2H3;3-5,7H,6H2,1-2H3,(H,13,15);3-8H,1-2H3,(H,13,14);3-8,14H,1-2H3;3-5,8H,6-7H2,1-2H3;4-7H,1-3H3;4-7H,1-3H3,(H,12,13);3-6H,1-2H3,(H3,11,12,13).
What are the key properties of 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one?
3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one has a molecular weight of 2776.66 g/mol, XLogP of 40.52, 23 rotatable bonds, 9 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;2-imidazol-1-yl-5-propan-2-ylaniline;2-methyl-6-propan-2-yl-1H-benzimidazole;5-methyl-3-(3-propan-2-ylphenyl)-1,2,4-oxadiazole;5-methyl-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole;4-methyl-5-propan-2-yl-2-pyrazin-2-yl-1,3-thiazole;1-(2-nitro-4-propan-2-ylphenyl)imidazole;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,4-dihydroquinoline-2,3-dione;2-propan-2-yl-1H-indole-6-carbonitrile;5-(4-propan-2-ylphenyl)-1H-pyrazole;2-propan-2-ylquinolin-8-ol;6-propan-2-yl-1H-quinolin-2-one;6-propan-2-yl-4H-thiochromen-3-one is sourced from PubChem (CID 162030544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).