6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline

C246H335N27O5S — CID 160712437

IUPAC6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline
SMILESC=C1C=Nc2cccc(C(C)(C)C)c2N1.CC(=O)N1CCc2c(cccc2C(C)(C)C)C1.CC(C)(C)c1c(CN2CCOCC2)ccc2cccnc12.CC(C)(C)c1ccc2cnn(C3CCCCC3)c2c1.CC(C)(C)c1ccc2cnn(C3CCNC3)c2c1.CC(C)(C)c1cccc2c1CCCC2.CC(C)(C)c1cccc2c1CCCN2.CC(C)(C)c1cccc2c1CCN(S(C)(=O)=O)C2.CC(C)(C)c1cccc2ccccc12.CC(C)(C)c1cccc2nccnc12.CN(C)c1ccc2cccc(C(C)(C)C)c2n1.CN1CCC(n2ncc3ccc(C(C)(C)C)cc32)C1.CN1CCC(n2ncc3ccc(C(C)(C)C)cc32)CC1.CN1CCc2c(cccc2C(C)(C)C)C1.COc1ccc2cccc(C(C)(C)C)c2n1.Cn1cc2cccc(C(C)(C)C)c2c1.Cn1ncc2c(C(C)(C)C)cccc21
InChIInChI=1S/C18H24N2O.C17H25N3.C17H24N2.C16H23N3.C15H21N3.C15H20N2.C15H21NO.C14H21NO2S.C14H17NO.C14H21N.C14H20.C14H16.C13H16N2.C13H17N.C13H19N.C12H16N2.C12H14N2/c1-18(2,3)16-15(13-20-9-11-21-12-10-20)7-6-14-5-4-8-19-17(14)16;1-17(2,3)14-6-5-13-12-18-20(16(13)11-14)15-7-9-19(4)10-8-15;1-17(2,3)14-10-9-13-12-18-19(16(13)11-14)15-7-5-4-6-8-15;1-16(2,3)13-6-5-12-10-17-19(15(12)9-13)14-7-8-18(4)11-14;1-15(2,3)12-5-4-11-9-17-18(14(11)8-12)13-6-7-16-10-13;1-15(2,3)12-8-6-7-11-9-10-13(17(4)5)16-14(11)12;1-11(17)16-9-8-13-12(10-16)6-5-7-14(13)15(2,3)4;1-14(2,3)13-7-5-6-11-10-15(18(4,16)17)9-8-12(11)13;1-14(2,3)11-7-5-6-10-8-9-12(16-4)15-13(10)11;1-14(2,3)13-7-5-6-11-10-15(4)9-8-12(11)13;2*1-14(2,3)13-10-6-8-11-7-4-5-9-12(11)13;1-9-8-14-11-7-5-6-10(12(11)15-9)13(2,3)4;1-13(2,3)12-7-5-6-10-8-14(4)9-11(10)12;1-13(2,3)11-7-4-8-12-10(11)6-5-9-14-12;1-12(2,3)10-6-5-7-11-9(10)8-13-14(11)4;1-12(2,3)9-5-4-6-10-11(9)14-8-7-13-10/h4-8H,9-13H2,1-3H3;5-6,11-12,15H,7-10H2,1-4H3;9-12,15H,4-8H2,1-3H3;5-6,9-10,14H,7-8,11H2,1-4H3;4-5,8-9,13,16H,6-7,10H2,1-3H3;6-10H,1-5H3;5-7H,8-10H2,1-4H3;5-7H,8-10H2,1-4H3;5-9H,1-4H3;5-7H,8-10H2,1-4H3;6,8,10H,4-5,7,9H2,1-3H3;4-10H,1-3H3;5-8,15H,1H2,2-4H3;5-9H,1-4H3;4,7-8,14H,5-6,9H2,1-3H3;5-8H,1-4H3;4-8H,1-3H3
InChIKeyRSAOXMJPTIWYSB-UHFFFAOYSA-N
MW3782.64 g/mol
LogP57.43
Rot. Bonds9

About 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline

6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline (PubChem CID 160712437) has the molecular formula C246H335N27O5S and a molecular weight of 3782.64 g/mol. Its IUPAC name is 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline
PubChem CID160712437
Molecular FormulaC246H335N27O5S
Molecular Weight3782.64 g/mol
Exact Mass3779.65
IUPAC Name6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline
SMILESC=C1C=Nc2cccc(C(C)(C)C)c2N1.CC(=O)N1CCc2c(cccc2C(C)(C)C)C1.CC(C)(C)c1c(CN2CCOCC2)ccc2cccnc12.CC(C)(C)c1ccc2cnn(C3CCCCC3)c2c1.CC(C)(C)c1ccc2cnn(C3CCNC3)c2c1.CC(C)(C)c1cccc2c1CCCC2.CC(C)(C)c1cccc2c1CCCN2.CC(C)(C)c1cccc2c1CCN(S(C)(=O)=O)C2.CC(C)(C)c1cccc2ccccc12.CC(C)(C)c1cccc2nccnc12.CN(C)c1ccc2cccc(C(C)(C)C)c2n1.CN1CCC(n2ncc3ccc(C(C)(C)C)cc32)C1.CN1CCC(n2ncc3ccc(C(C)(C)C)cc32)CC1.CN1CCc2c(cccc2C(C)(C)C)C1.COc1ccc2cccc(C(C)(C)C)c2n1.Cn1cc2cccc(C(C)(C)C)c2c1.Cn1ncc2c(C(C)(C)C)cccc21
InChIInChI=1S/C18H24N2O.C17H25N3.C17H24N2.C16H23N3.C15H21N3.C15H20N2.C15H21NO.C14H21NO2S.C14H17NO.C14H21N.C14H20.C14H16.C13H16N2.C13H17N.C13H19N.C12H16N2.C12H14N2/c1-18(2,3)16-15(13-20-9-11-21-12-10-20)7-6-14-5-4-8-19-17(14)16;1-17(2,3)14-6-5-13-12-18-20(16(13)11-14)15-7-9-19(4)10-8-15;1-17(2,3)14-10-9-13-12-18-19(16(13)11-14)15-7-5-4-6-8-15;1-16(2,3)13-6-5-12-10-17-19(15(12)9-13)14-7-8-18(4)11-14;1-15(2,3)12-5-4-11-9-17-18(14(11)8-12)13-6-7-16-10-13;1-15(2,3)12-8-6-7-11-9-10-13(17(4)5)16-14(11)12;1-11(17)16-9-8-13-12(10-16)6-5-7-14(13)15(2,3)4;1-14(2,3)13-7-5-6-11-10-15(18(4,16)17)9-8-12(11)13;1-14(2,3)11-7-5-6-10-8-9-12(16-4)15-13(10)11;1-14(2,3)13-7-5-6-11-10-15(4)9-8-12(11)13;2*1-14(2,3)13-10-6-8-11-7-4-5-9-12(11)13;1-9-8-14-11-7-5-6-10(12(11)15-9)13(2,3)4;1-13(2,3)12-7-5-6-10-8-14(4)9-11(10)12;1-13(2,3)11-7-4-8-12-10(11)6-5-9-14-12;1-12(2,3)10-6-5-7-11-9(10)8-13-14(11)4;1-12(2,3)9-5-4-6-10-11(9)14-8-7-13-10/h4-8H,9-13H2,1-3H3;5-6,11-12,15H,7-10H2,1-4H3;9-12,15H,4-8H2,1-3H3;5-6,9-10,14H,7-8,11H2,1-4H3;4-5,8-9,13,16H,6-7,10H2,1-3H3;6-10H,1-5H3;5-7H,8-10H2,1-4H3;5-7H,8-10H2,1-4H3;5-9H,1-4H3;5-7H,8-10H2,1-4H3;6,8,10H,4-5,7,9H2,1-3H3;4-10H,1-3H3;5-8,15H,1H2,2-4H3;5-9H,1-4H3;4,7-8,14H,5-6,9H2,1-3H3;5-8H,1-4H3;4-8H,1-3H3
InChIKeyRSAOXMJPTIWYSB-UHFFFAOYSA-N
XLogP57.43
TPSA299.28 Ų
H-Bond Donors3
H-Bond Acceptors30
Rotatable Bonds9
Heavy Atoms279
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003782.64
LogP ≤ 557.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1030

Analyze 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline (CID 160712437) is 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline is C=C1C=Nc2cccc(C(C)(C)C)c2N1.CC(=O)N1CCc2c(cccc2C(C)(C)C)C1.CC(C)(C)c1c(CN2CCOCC2)ccc2cccnc12.CC(C)(C)c1ccc2cnn(C3CCCCC3)c2c1.CC(C)(C)c1ccc2cnn(C3CCNC3)c2c1.CC(C)(C)c1cccc2c1CCCC2.CC(C)(C)c1cccc2c1CCCN2.CC(C)(C)c1cccc2c1CCN(S(C)(=O)=O)C2.CC(C)(C)c1cccc2ccccc12.CC(C)(C)c1cccc2nccnc12.CN(C)c1ccc2cccc(C(C)(C)C)c2n1.CN1CCC(n2ncc3ccc(C(C)(C)C)cc32)C1.CN1CCC(n2ncc3ccc(C(C)(C)C)cc32)CC1.CN1CCc2c(cccc2C(C)(C)C)C1.COc1ccc2cccc(C(C)(C)C)c2n1.Cn1cc2cccc(C(C)(C)C)c2c1.Cn1ncc2c(C(C)(C)C)cccc21.
What is the InChIKey of 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is RSAOXMJPTIWYSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O.C17H25N3.C17H24N2.C16H23N3.C15H21N3.C15H20N2.C15H21NO.C14H21NO2S.C14H17NO.C14H21N.C14H20.C14H16.C13H16N2.C13H17N.C13H19N.C12H16N2.C12H14N2/c1-18(2,3)16-15(13-20-9-11-21-12-10-20)7-6-14-5-4-8-19-17(14)16;1-17(2,3)14-6-5-13-12-18-20(16(13)11-14)15-7-9-19(4)10-8-15;1-17(2,3)14-10-9-13-12-18-19(16(13)11-14)15-7-5-4-6-8-15;1-16(2,3)13-6-5-12-10-17-19(15(12)9-13)14-7-8-18(4)11-14;1-15(2,3)12-5-4-11-9-17-18(14(11)8-12)13-6-7-16-10-13;1-15(2,3)12-8-6-7-11-9-10-13(17(4)5)16-14(11)12;1-11(17)16-9-8-13-12(10-16)6-5-7-14(13)15(2,3)4;1-14(2,3)13-7-5-6-11-10-15(18(4,16)17)9-8-12(11)13;1-14(2,3)11-7-5-6-10-8-9-12(16-4)15-13(10)11;1-14(2,3)13-7-5-6-11-10-15(4)9-8-12(11)13;2*1-14(2,3)13-10-6-8-11-7-4-5-9-12(11)13;1-9-8-14-11-7-5-6-10(12(11)15-9)13(2,3)4;1-13(2,3)12-7-5-6-10-8-14(4)9-11(10)12;1-13(2,3)11-7-4-8-12-10(11)6-5-9-14-12;1-12(2,3)10-6-5-7-11-9(10)8-13-14(11)4;1-12(2,3)9-5-4-6-10-11(9)14-8-7-13-10/h4-8H,9-13H2,1-3H3;5-6,11-12,15H,7-10H2,1-4H3;9-12,15H,4-8H2,1-3H3;5-6,9-10,14H,7-8,11H2,1-4H3;4-5,8-9,13,16H,6-7,10H2,1-3H3;6-10H,1-5H3;5-7H,8-10H2,1-4H3;5-7H,8-10H2,1-4H3;5-9H,1-4H3;5-7H,8-10H2,1-4H3;6,8,10H,4-5,7,9H2,1-3H3;4-10H,1-3H3;5-8,15H,1H2,2-4H3;5-9H,1-4H3;4,7-8,14H,5-6,9H2,1-3H3;5-8H,1-4H3;4-8H,1-3H3.
What are the key properties of 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline?
6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 3782.64 g/mol, XLogP of 57.43, 9 rotatable bonds, 3 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-1-cyclohexylindazole;1-(5-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;8-tert-butyl-N,N-dimethylquinolin-2-amine;8-tert-butyl-2-methoxyquinoline;5-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinoline;8-tert-butyl-2-methylidene-1H-quinoxaline;4-tert-butyl-1-methylindazole;4-tert-butyl-2-methylisoindole;6-tert-butyl-1-(1-methylpiperidin-4-yl)indazole;6-tert-butyl-1-(1-methylpyrrolidin-3-yl)indazole;5-tert-butyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline;1-tert-butylnaphthalene;6-tert-butyl-1-pyrrolidin-3-ylindazole;4-[(8-tert-butylquinolin-7-yl)methyl]morpholine;5-tert-butylquinoxaline;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;5-tert-butyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 160712437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).