4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine

C176H225BrN22O7S2 — CID 158929977

IUPAC4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine
SMILESCC(=O)Nc1cc(C)nc(C(C)C)c1.CC(C)c1ccccn1.CC(C)n1cc(Br)cn1.COc1cccc(-c2cc(C)nc(C(C)C)c2)c1.Cc1cc(-c2ccccc2)cc(C(C)C)n1.Cc1cc(-c2ccccc2C)cc(C(C)C)n1.Cc1cc(-c2ccn[nH]2)cc(C(C)C)n1.Cc1cc(-c2ccncc2)cc(C(C)(C)C)n1.Cc1cc(C)nc(C(C)C)c1.Cc1cc(NC(=O)c2ccccc2)cc(C(C)C)n1.Cc1cc(NS(=O)(=O)c2ccccc2)cc(C(C)(C)C)n1.Cc1cc(NS(C)(=O)=O)cc(C(C)C)n1.Cc1cccc(-c2cc(C)nc(C(C)C)c2)c1.Cc1cccc(C(C)C)n1
InChIInChI=1S/C16H20N2O2S.C16H18N2O.C16H19NO.2C16H19N.C15H18N2.C15H17N.C12H15N3.C11H16N2O.C10H16N2O2S.C10H15N.C9H13N.C8H11N.C6H9BrN2/c1-12-10-13(11-15(17-12)16(2,3)4)18-21(19,20)14-8-6-5-7-9-14;1-11(2)15-10-14(9-12(3)17-15)18-16(19)13-7-5-4-6-8-13;1-11(2)16-10-14(8-12(3)17-16)13-6-5-7-15(9-13)18-4;1-11(2)16-10-15(9-13(4)17-16)14-7-5-6-12(3)8-14;1-11(2)16-10-14(9-13(4)17-16)15-8-6-5-7-12(15)3;1-11-9-13(12-5-7-16-8-6-12)10-14(17-11)15(2,3)4;1-11(2)15-10-14(9-12(3)16-15)13-7-5-4-6-8-13;1-8(2)12-7-10(6-9(3)14-12)11-4-5-13-15-11;1-7(2)11-6-10(13-9(4)14)5-8(3)12-11;1-7(2)10-6-9(5-8(3)11-10)12-15(4,13)14;1-7(2)10-6-8(3)5-9(4)11-10;1-7(2)9-6-4-5-8(3)10-9;1-7(2)8-5-3-4-6-9-8;1-5(2)9-4-6(7)3-8-9/h5-11H,1-4H3,(H,17,18);4-11H,1-3H3,(H,17,18,19);5-11H,1-4H3;2*5-11H,1-4H3;5-10H,1-4H3;4-11H,1-3H3;4-8H,1-3H3,(H,13,15);5-7H,1-4H3,(H,12,13,14);5-7H,1-4H3,(H,11,12);5-7H,1-4H3;4-7H,1-3H3;3-7H,1-2H3;3-5H,1-2H3
InChIKeyJIXUTVBAPXSVHK-UHFFFAOYSA-N
MW2904.92 g/mol
LogP45.38
Rot. Bonds27

About 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine

4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine (PubChem CID 158929977) has the molecular formula C176H225BrN22O7S2 and a molecular weight of 2904.92 g/mol. Its IUPAC name is 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine.

Molecular Properties

Compound Name4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine
PubChem CID158929977
Molecular FormulaC176H225BrN22O7S2
Molecular Weight2904.92 g/mol
Exact Mass2901.66
IUPAC Name4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine
SMILESCC(=O)Nc1cc(C)nc(C(C)C)c1.CC(C)c1ccccn1.CC(C)n1cc(Br)cn1.COc1cccc(-c2cc(C)nc(C(C)C)c2)c1.Cc1cc(-c2ccccc2)cc(C(C)C)n1.Cc1cc(-c2ccccc2C)cc(C(C)C)n1.Cc1cc(-c2ccn[nH]2)cc(C(C)C)n1.Cc1cc(-c2ccncc2)cc(C(C)(C)C)n1.Cc1cc(C)nc(C(C)C)c1.Cc1cc(NC(=O)c2ccccc2)cc(C(C)C)n1.Cc1cc(NS(=O)(=O)c2ccccc2)cc(C(C)(C)C)n1.Cc1cc(NS(C)(=O)=O)cc(C(C)C)n1.Cc1cccc(-c2cc(C)nc(C(C)C)c2)c1.Cc1cccc(C(C)C)n1
InChIInChI=1S/C16H20N2O2S.C16H18N2O.C16H19NO.2C16H19N.C15H18N2.C15H17N.C12H15N3.C11H16N2O.C10H16N2O2S.C10H15N.C9H13N.C8H11N.C6H9BrN2/c1-12-10-13(11-15(17-12)16(2,3)4)18-21(19,20)14-8-6-5-7-9-14;1-11(2)15-10-14(9-12(3)17-15)18-16(19)13-7-5-4-6-8-13;1-11(2)16-10-14(8-12(3)17-16)13-6-5-7-15(9-13)18-4;1-11(2)16-10-15(9-13(4)17-16)14-7-5-6-12(3)8-14;1-11(2)16-10-14(9-13(4)17-16)15-8-6-5-7-12(15)3;1-11-9-13(12-5-7-16-8-6-12)10-14(17-11)15(2,3)4;1-11(2)15-10-14(9-12(3)16-15)13-7-5-4-6-8-13;1-8(2)12-7-10(6-9(3)14-12)11-4-5-13-15-11;1-7(2)11-6-10(13-9(4)14)5-8(3)12-11;1-7(2)10-6-9(5-8(3)11-10)12-15(4,13)14;1-7(2)10-6-8(3)5-9(4)11-10;1-7(2)9-6-4-5-8(3)10-9;1-7(2)8-5-3-4-6-9-8;1-5(2)9-4-6(7)3-8-9/h5-11H,1-4H3,(H,17,18);4-11H,1-3H3,(H,17,18,19);5-11H,1-4H3;2*5-11H,1-4H3;5-10H,1-4H3;4-11H,1-3H3;4-8H,1-3H3,(H,13,15);5-7H,1-4H3,(H,12,13,14);5-7H,1-4H3,(H,11,12);5-7H,1-4H3;4-7H,1-3H3;3-7H,1-2H3;3-5H,1-2H3
InChIKeyJIXUTVBAPXSVHK-UHFFFAOYSA-N
XLogP45.38
TPSA386.73 Ų
H-Bond Donors5
H-Bond Acceptors24
Rotatable Bonds27
Heavy Atoms208
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002904.92
LogP ≤ 545.38
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1024

Analyze 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine with MolForge

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Launch Full Analysis

Related Compounds

3-tert-butylbenzamide;4-tert-butylbenzamide;tert-butylbenzene;4-tert-butylbenzenesulfonamide;4-tert-butyl-2-(2-tert-butylphenyl)pyridine;1-tert-butyl-3-(methylsulfonylmethyl)benzene;2-(3-tert-butylphenoxy)-N,N-dimethylethanamine;N-(4-tert-butylphenyl)acetamide;N-(2-tert-butylphenyl)methanesulfonamide;N-[(3-tert-butylphenyl)methyl]oxan-4-amine;4-[(3-tert-butylphenyl)methyl]oxane;5-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)morpholine;1-(3-tert-butylphenyl)propan-2-one;5-(3-tert-butylphenyl)-1H-pyrazole;2-(3-tert-butylphenyl)pyridine;2-(4-tert-butylphenyl)pyridine;3-(3-tert-butylphenyl)pyridine
CID 157068884
4-bromo-1-propan-2-ylpyrazole;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzenesulfonamide;3-(2-methyl-6-propan-2-yl-4-pyridinyl)benzonitrile;4-(2-methyl-6-propan-2-yl-4-pyridinyl)benzonitrile;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-methyl-6-propan-2-yl-4-pyridin-4-ylpyridine
CID 158708951
3-tert-butylbenzamide;4-tert-butylbenzamide;tert-butylbenzene;4-tert-butylbenzenesulfonamide;1-tert-butyl-3-(methylsulfonylmethyl)benzene;2-(3-tert-butylphenoxy)-N,N-dimethylethanamine;N-(4-tert-butylphenyl)acetamide;N-(2-tert-butylphenyl)methanesulfonamide;N-[(3-tert-butylphenyl)methyl]oxan-4-amine;4-[(3-tert-butylphenyl)methyl]oxane;5-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)morpholine;1-(3-tert-butylphenyl)propan-2-one;5-(3-tert-butylphenyl)-1H-pyrazole;2-(2-tert-butylphenyl)pyridine;2-(3-tert-butylphenyl)pyridine;2-(4-tert-butylphenyl)pyridine;3-(3-tert-butylphenyl)pyridine
CID 158896046
3-tert-butylbenzamide;4-tert-butylbenzamide;tert-butylbenzene;4-tert-butylbenzenesulfonamide;1-tert-butyl-3-(methylsulfonylmethyl)benzene;2-(3-tert-butylphenoxy)-N,N-dimethylethanamine;N-(4-tert-butylphenyl)acetamide;N-(2-tert-butylphenyl)methanesulfonamide;1-[(3-tert-butylphenyl)methyl]-4-methylpiperazine;N-[(3-tert-butylphenyl)methyl]oxan-4-amine;4-[(3-tert-butylphenyl)methyl]oxane;1-[(3-tert-butylphenyl)methyl]piperazine;5-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)morpholine;1-(3-tert-butylphenyl)propan-2-one;5-(3-tert-butylphenyl)-1H-pyrazole;2-(2-tert-butylphenyl)pyridine;2-(3-tert-butylphenyl)pyridine;2-(4-tert-butylphenyl)pyridine;3-(3-tert-butylphenyl)pyridine
CID 160031513

Frequently Asked Questions

What is the IUPAC name of 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine?
The IUPAC name of 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine (CID 158929977) is 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine.
What is the SMILES notation for 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine?
The canonical SMILES for 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine is CC(=O)Nc1cc(C)nc(C(C)C)c1.CC(C)c1ccccn1.CC(C)n1cc(Br)cn1.COc1cccc(-c2cc(C)nc(C(C)C)c2)c1.Cc1cc(-c2ccccc2)cc(C(C)C)n1.Cc1cc(-c2ccccc2C)cc(C(C)C)n1.Cc1cc(-c2ccn[nH]2)cc(C(C)C)n1.Cc1cc(-c2ccncc2)cc(C(C)(C)C)n1.Cc1cc(C)nc(C(C)C)c1.Cc1cc(NC(=O)c2ccccc2)cc(C(C)C)n1.Cc1cc(NS(=O)(=O)c2ccccc2)cc(C(C)(C)C)n1.Cc1cc(NS(C)(=O)=O)cc(C(C)C)n1.Cc1cccc(-c2cc(C)nc(C(C)C)c2)c1.Cc1cccc(C(C)C)n1.
What is the InChIKey of 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine?
The InChIKey is JIXUTVBAPXSVHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S.C16H18N2O.C16H19NO.2C16H19N.C15H18N2.C15H17N.C12H15N3.C11H16N2O.C10H16N2O2S.C10H15N.C9H13N.C8H11N.C6H9BrN2/c1-12-10-13(11-15(17-12)16(2,3)4)18-21(19,20)14-8-6-5-7-9-14;1-11(2)15-10-14(9-12(3)17-15)18-16(19)13-7-5-4-6-8-13;1-11(2)16-10-14(8-12(3)17-16)13-6-5-7-15(9-13)18-4;1-11(2)16-10-15(9-13(4)17-16)14-7-5-6-12(3)8-14;1-11(2)16-10-14(9-13(4)17-16)15-8-6-5-7-12(15)3;1-11-9-13(12-5-7-16-8-6-12)10-14(17-11)15(2,3)4;1-11(2)15-10-14(9-12(3)16-15)13-7-5-4-6-8-13;1-8(2)12-7-10(6-9(3)14-12)11-4-5-13-15-11;1-7(2)11-6-10(13-9(4)14)5-8(3)12-11;1-7(2)10-6-9(5-8(3)11-10)12-15(4,13)14;1-7(2)10-6-8(3)5-9(4)11-10;1-7(2)9-6-4-5-8(3)10-9;1-7(2)8-5-3-4-6-9-8;1-5(2)9-4-6(7)3-8-9/h5-11H,1-4H3,(H,17,18);4-11H,1-3H3,(H,17,18,19);5-11H,1-4H3;2*5-11H,1-4H3;5-10H,1-4H3;4-11H,1-3H3;4-8H,1-3H3,(H,13,15);5-7H,1-4H3,(H,12,13,14);5-7H,1-4H3,(H,11,12);5-7H,1-4H3;4-7H,1-3H3;3-7H,1-2H3;3-5H,1-2H3.
What are the key properties of 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine?
4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine has a molecular weight of 2904.92 g/mol, XLogP of 45.38, 27 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-propan-2-ylpyrazole;N-(2-tert-butyl-6-methyl-4-pyridinyl)benzenesulfonamide;2-tert-butyl-6-methyl-4-pyridin-4-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;4-(3-methoxyphenyl)-2-methyl-6-propan-2-ylpyridine;2-methyl-4-(2-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-(3-methylphenyl)-6-propan-2-ylpyridine;2-methyl-4-phenyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-yl-4-(1H-pyrazol-5-yl)pyridine;2-methyl-6-propan-2-ylpyridine;N-(2-methyl-6-propan-2-yl-4-pyridinyl)acetamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)benzamide;N-(2-methyl-6-propan-2-yl-4-pyridinyl)methanesulfonamide;2-propan-2-ylpyridine is sourced from PubChem (CID 158929977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).