3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol

C155H222F2N24O14S — CID 158701723

IUPAC3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol
SMILESCC(C)c1ccc(C(=O)N(C)C)cn1.CC(C)c1ccc(C(=O)N2CCN(C)CC2)cn1.CC(C)c1ccc(C(=O)N2CCN(CCO)CC2)cn1.CC(C)c1ccc(C(=O)N2CCOCC2)cn1.CC(C)c1ccc(C(=O)N2CCOCC2)cn1.CC(C)c1ccc(CO)cn1.CC(C)c1ccc(S(=O)(=O)N(C)C)cn1.CC(C)c1cccc(N)n1.CC(C)c1cccnc1.CC(C)c1ncc(F)cc1F.COC(=O)c1cccc(C(C)C)n1.COc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)c1
InChIInChI=1S/C15H23N3O2.C14H21N3O.2C13H18N2O2.C11H16N2O.C10H16N2O2S.C10H13NO2.2C9H13NO.3C9H13N.C8H9F2N.C8H12N2.C8H11N/c1-12(2)14-4-3-13(11-16-14)15(20)18-7-5-17(6-8-18)9-10-19;1-11(2)13-5-4-12(10-15-13)14(18)17-8-6-16(3)7-9-17;2*1-10(2)12-4-3-11(9-14-12)13(16)15-5-7-17-8-6-15;1-8(2)10-6-5-9(7-12-10)11(14)13(3)4;1-8(2)10-6-5-9(7-11-10)15(13,14)12(3)4;1-7(2)8-5-4-6-9(11-8)10(12)13-3;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)9-4-3-8(6-11)5-10-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-6-4-5-8(3)10-9;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-4-3-5-8(9)10-7;1-7(2)8-4-3-5-9-6-8/h3-4,11-12,19H,5-10H2,1-2H3;4-5,10-11H,6-9H2,1-3H3;2*3-4,9-10H,5-8H2,1-2H3;5-8H,1-4H3;5-8H,1-4H3;4-7H,1-3H3;4-7H,1-3H3;3-5,7,11H,6H2,1-2H3;3*4-7H,1-3H3;3-5H,1-2H3;3-6H,1-2H3,(H2,9,10);3-7H,1-2H3
InChIKeyIHPWFBUPIJBJFR-UHFFFAOYSA-N
MW2715.70 g/mol
LogP29.18
Rot. Bonds27

About 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol

3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol (PubChem CID 158701723) has the molecular formula C155H222F2N24O14S and a molecular weight of 2715.70 g/mol. Its IUPAC name is 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol.

Molecular Properties

Compound Name3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol
PubChem CID158701723
Molecular FormulaC155H222F2N24O14S
Molecular Weight2715.70 g/mol
Exact Mass2713.71
IUPAC Name3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol
SMILESCC(C)c1ccc(C(=O)N(C)C)cn1.CC(C)c1ccc(C(=O)N2CCN(C)CC2)cn1.CC(C)c1ccc(C(=O)N2CCN(CCO)CC2)cn1.CC(C)c1ccc(C(=O)N2CCOCC2)cn1.CC(C)c1ccc(C(=O)N2CCOCC2)cn1.CC(C)c1ccc(CO)cn1.CC(C)c1ccc(S(=O)(=O)N(C)C)cn1.CC(C)c1cccc(N)n1.CC(C)c1cccnc1.CC(C)c1ncc(F)cc1F.COC(=O)c1cccc(C(C)C)n1.COc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)c1
InChIInChI=1S/C15H23N3O2.C14H21N3O.2C13H18N2O2.C11H16N2O.C10H16N2O2S.C10H13NO2.2C9H13NO.3C9H13N.C8H9F2N.C8H12N2.C8H11N/c1-12(2)14-4-3-13(11-16-14)15(20)18-7-5-17(6-8-18)9-10-19;1-11(2)13-5-4-12(10-15-13)14(18)17-8-6-16(3)7-9-17;2*1-10(2)12-4-3-11(9-14-12)13(16)15-5-7-17-8-6-15;1-8(2)10-6-5-9(7-12-10)11(14)13(3)4;1-8(2)10-6-5-9(7-11-10)15(13,14)12(3)4;1-7(2)8-5-4-6-9(11-8)10(12)13-3;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)9-4-3-8(6-11)5-10-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-6-4-5-8(3)10-9;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-4-3-5-8(9)10-7;1-7(2)8-4-3-5-9-6-8/h3-4,11-12,19H,5-10H2,1-2H3;4-5,10-11H,6-9H2,1-3H3;2*3-4,9-10H,5-8H2,1-2H3;5-8H,1-4H3;5-8H,1-4H3;4-7H,1-3H3;4-7H,1-3H3;3-5,7,11H,6H2,1-2H3;3*4-7H,1-3H3;3-5H,1-2H3;3-6H,1-2H3,(H2,9,10);3-7H,1-2H3
InChIKeyIHPWFBUPIJBJFR-UHFFFAOYSA-N
XLogP29.18
TPSA459.23 Ų
H-Bond Donors3
H-Bond Acceptors32
Rotatable Bonds27
Heavy Atoms196
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002715.70
LogP ≤ 529.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1032

Analyze 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Methyl 2-[2-[2-(6-acetamido-3-pyridinyl)-6-methoxy-3-pyridinyl]-5-methoxy-3-pyridinyl]-4-(5-fluoro-2-pyridin-3-yl-3-pyridinyl)-5-(6-methoxycarbonyl-2-pyridinyl)pyridine-3-carboxylate
CID 123161154
Methyl 2-[4-[2-[2-[6-acetamido-2-[2-(2-methoxy-3-pyridin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-3-pyridinyl]-6-methoxy-3-pyridinyl]-5-methoxy-3-pyridinyl]-2-methoxy-3-pyridinyl]-4-(5-fluoro-2-pyridin-3-yl-3-pyridinyl)-5-(6-methoxycarbonyl-2-pyridinyl)pyridine-3-carboxylate
CID 123986562
phenyl (2S)-2-[[2,5-difluoro-4-[[5-[2-(oxan-4-yl)-4-pyridinyl]-2-pyridinyl]sulfonylamino]benzoyl]amino]-4-[5-(1-methyl-2,4-dioxopyrido[3,4-d]pyrimidin-3-yl)-2-pyridinyl]butanoate
CID 132147086
2-Amino-6-(trifluoromethyl)pyridine-3-carboxamide;diethyl 6-aminopyridine-2,5-dicarboxylate;6-(difluoromethyl)-2-methylpyridine-3-carboxylic acid;5-ethoxycarbonyl-6-methylpyridine-2-carboxylic acid;ethyl 6-(difluoromethyl)-2-methylpyridine-3-carboxylate;2-methyl-3-methylsulfonyl-6-(trifluoromethyl)pyridine;3-methylsulfonyl-2-phenyl-6-(trifluoromethyl)pyridine;3-methylsulfonyl-2-pyridin-2-yl-6-(trifluoromethyl)pyridine
CID 158671894
Tris(carbon dioxide);bis(2,3-dimethyl-6-propan-2-ylpyridine);4,5-dimethyl-2-propan-2-ylpyridine;3-fluoro-2-methyl-6-propan-2-ylpyridine;methane;2-methoxy-3-methyl-6-propan-2-ylpyridine;3-methoxy-2-methyl-6-propan-2-ylpyridine;3-methyl-6-propan-2-ylpyridin-2-amine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-2-carboxylic acid;5-methyl-2-propan-2-ylpyridine-4-carboxylic acid;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carboxylic acid;3-propan-2-yl-5-(trifluoromethyl)pyridine-2-carboxylic acid
CID 160925739
5-[3-[3-[6-acetamido-3-[3-[2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-2,5-dihydropyridin-4-yl]-6-morpholin-4-yl-2-pyridinyl]-2-pyridinyl]-6-(dimethylamino)-2-pyridinyl]-6-methoxy-2-pyridinyl]-N-methyl-6-[2-(6-methyl-2-pyridin-4-yloxy-3-pyridinyl)-6-(methylsulfamoyl)-3-pyridinyl]pyridine-2-carboxamide
CID 123195089
2-Amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-6-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxylic acid;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;bis(4-methyl-2-propan-2-ylpyrimidine);4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-5-carboxylic acid
CID 157976598
2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen
CID 158159971
2-tert-butyl-5-ethoxypyridine;2-tert-butyl-5-methoxypyridine;3-tert-butyl-2-methoxypyridine;5-tert-butyl-2-methoxypyridine;6-tert-butyl-N-methylpyridine-3-carboxamide;2-tert-butyl-5-(methylsulfonylmethyl)pyridine;6-tert-butylpyridine-2-carboxylic acid;6-tert-butylpyridine-3-carboxylic acid;5-tert-butylpyridin-3-ol;6-tert-butylpyridin-3-ol;2-tert-butyl-1H-pyridin-4-one;3-tert-butyl-1H-pyridin-2-one;4-tert-butyl-1H-pyridin-2-one;5-tert-butyl-1H-pyridin-2-one;6-tert-butyl-1H-pyridin-2-one;1-(6-tert-butyl-3-pyridinyl)ethanone;methyl 6-tert-butylpyridine-3-carboxylate
CID 159183229
3-(2,2-difluoroethoxy)-2-methoxy-5-propan-2-ylpyridine;3-(2,2-difluoroethoxy)-2-methyl-5-propan-2-ylpyridine;3-(2,2-difluoroethoxy)-5-propan-2-ylpyridine;3-(difluoromethoxy)-2-methoxy-5-propan-2-ylpyridine;3-(difluoromethoxy)-5-propan-2-ylpyridin-2-amine;3-(difluoromethoxy)-5-propan-2-ylpyridine;3-ethoxy-2-methoxy-5-propan-2-ylpyridine;3-ethoxy-5-propan-2-ylpyridine;2-ethyl-3-methoxy-5-propan-2-ylpyridine;N-ethyl-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;N-ethyl-2-methyl-5-propan-2-ylpyridine-3-carboxamide;3-(2-fluoroethoxy)-5-propan-2-ylpyridine;2-fluoro-3-methoxy-5-propan-2-ylpyridine;3-fluoro-2-methoxy-5-propan-2-ylpyridine;2-methoxy-N,N-dimethyl-5-propan-2-ylpyridine-3-sulfonamide;(2-methoxy-5-propan-2-yl-3-pyridinyl)methanol
CID 159371889
2-amino-N-methyl-5-propan-2-ylpyridine-3-carboxamide;2-chloro-3-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridine-3-carboxamide;5-fluoro-4-propan-2-ylpyridine-2-carboxamide;2-methoxy-6-propan-2-ylpyridine-4-carboxamide;methyl 2-amino-5-propan-2-ylpyridine-3-carboxylate;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine-3-carboxamide;4-methyl-5-propan-2-ylpyridine-3-carboxamide;N-methyl-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-ylpyridin-2-amine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine-4-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;5-propan-2-ylpyridine-3-carboxamide;5-propan-2-ylpyridine-3-carboxylic acid;5-propan-2-ylpyridine-3-sulfonamide;2-(5-propan-2-yl-3-pyridinyl)acetamide
CID 159506054
2-Amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid
CID 160682146

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol?
The IUPAC name of 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol (CID 158701723) is 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol.
What is the SMILES notation for 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol?
The canonical SMILES for 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol is CC(C)c1ccc(C(=O)N(C)C)cn1.CC(C)c1ccc(C(=O)N2CCN(C)CC2)cn1.CC(C)c1ccc(C(=O)N2CCN(CCO)CC2)cn1.CC(C)c1ccc(C(=O)N2CCOCC2)cn1.CC(C)c1ccc(C(=O)N2CCOCC2)cn1.CC(C)c1ccc(CO)cn1.CC(C)c1ccc(S(=O)(=O)N(C)C)cn1.CC(C)c1cccc(N)n1.CC(C)c1cccnc1.CC(C)c1ncc(F)cc1F.COC(=O)c1cccc(C(C)C)n1.COc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)c1.
What is the InChIKey of 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol?
The InChIKey is IHPWFBUPIJBJFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2.C14H21N3O.2C13H18N2O2.C11H16N2O.C10H16N2O2S.C10H13NO2.2C9H13NO.3C9H13N.C8H9F2N.C8H12N2.C8H11N/c1-12(2)14-4-3-13(11-16-14)15(20)18-7-5-17(6-8-18)9-10-19;1-11(2)13-5-4-12(10-15-13)14(18)17-8-6-16(3)7-9-17;2*1-10(2)12-4-3-11(9-14-12)13(16)15-5-7-17-8-6-15;1-8(2)10-6-5-9(7-12-10)11(14)13(3)4;1-8(2)10-6-5-9(7-11-10)15(13,14)12(3)4;1-7(2)8-5-4-6-9(11-8)10(12)13-3;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)9-4-3-8(6-11)5-10-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-6-4-5-8(3)10-9;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-4-3-5-8(9)10-7;1-7(2)8-4-3-5-9-6-8/h3-4,11-12,19H,5-10H2,1-2H3;4-5,10-11H,6-9H2,1-3H3;2*3-4,9-10H,5-8H2,1-2H3;5-8H,1-4H3;5-8H,1-4H3;4-7H,1-3H3;4-7H,1-3H3;3-5,7,11H,6H2,1-2H3;3*4-7H,1-3H3;3-5H,1-2H3;3-6H,1-2H3,(H2,9,10);3-7H,1-2H3.
What are the key properties of 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol?
3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol has a molecular weight of 2715.70 g/mol, XLogP of 29.18, 27 rotatable bonds, 3 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;[4-(2-hydroxyethyl)piperazin-1-yl]-(6-propan-2-yl-3-pyridinyl)methanone;5-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(6-propan-2-yl-3-pyridinyl)methanone;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;methyl 6-propan-2-ylpyridine-2-carboxylate;bis(morpholin-4-yl-(6-propan-2-yl-3-pyridinyl)methanone);6-propan-2-ylpyridin-2-amine;3-propan-2-ylpyridine;(6-propan-2-yl-3-pyridinyl)methanol is sourced from PubChem (CID 158701723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).