(2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide

C103H161F6N31O12S2 — CID 159741839

IUPAC(2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide
SMILESCC(=O)N1CCC(Nc2nccc(C(C)C)n2)C1.CC(C)c1ccnc(NC2CCN(S(C)(=O)=O)C2)n1.CC(C)c1ccnc(NC[C@@H](C)NC(=O)C(F)(F)F)n1.CC(C)c1ccnc(NC[C@@H](C)NS(C)(=O)=O)n1.CC(C)c1ccnc(Nc2ccc(C(F)(F)F)cc2)n1.COCC(=O)NC[C@@H](C)Nc1nccc(C(C)C)n1.CO[C@@H](C)C(=O)NC[C@@H](C)Nc1nccc(C(C)C)n1.CO[C@@H](C)C(=O)N[C@H](C)CNc1nccc(C(C)C)n1
InChIInChI=1S/C14H14F3N3.2C14H24N4O2.C13H22N4O2.C13H20N4O.C12H17F3N4O.C12H20N4O2S.C11H20N4O2S/c1-9(2)12-7-8-18-13(20-12)19-11-5-3-10(4-6-11)14(15,16)17;1-9(2)12-6-7-15-14(18-12)16-8-10(3)17-13(19)11(4)20-5;1-9(2)12-6-7-15-14(18-12)17-10(3)8-16-13(19)11(4)20-5;1-9(2)11-5-6-14-13(17-11)16-10(3)7-15-12(18)8-19-4;1-9(2)12-4-6-14-13(16-12)15-11-5-7-17(8-11)10(3)18;1-7(2)9-4-5-16-11(19-9)17-6-8(3)18-10(20)12(13,14)15;1-9(2)11-4-6-13-12(15-11)14-10-5-7-16(8-10)19(3,17)18;1-8(2)10-5-6-12-11(14-10)13-7-9(3)15-18(4,16)17/h3-9H,1-2H3,(H,18,19,20);6-7,9-11H,8H2,1-5H3,(H,17,19)(H,15,16,18);6-7,9-11H,8H2,1-5H3,(H,16,19)(H,15,17,18);5-6,9-10H,7-8H2,1-4H3,(H,15,18)(H,14,16,17);4,6,9,11H,5,7-8H2,1-3H3,(H,14,15,16);4-5,7-8H,6H2,1-3H3,(H,18,20)(H,16,17,19);4,6,9-10H,5,7-8H2,1-3H3,(H,13,14,15);5-6,8-9,15H,7H2,1-4H3,(H,12,13,14)/t;2*10-,11+;10-;;8-;;9-/m.111.1.1/s1
InChIKeyNCOCRUGZTNYXDY-GVVVWNCOSA-N
MW2203.75 g/mol
LogP14.34
Rot. Bonds42

About (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide

(2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide (PubChem CID 159741839) has the molecular formula C103H161F6N31O12S2 and a molecular weight of 2203.75 g/mol. Its IUPAC name is (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide.

Molecular Properties

Compound Name(2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide
PubChem CID159741839
Molecular FormulaC103H161F6N31O12S2
Molecular Weight2203.75 g/mol
Exact Mass2202.23
IUPAC Name(2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide
SMILESCC(=O)N1CCC(Nc2nccc(C(C)C)n2)C1.CC(C)c1ccnc(NC2CCN(S(C)(=O)=O)C2)n1.CC(C)c1ccnc(NC[C@@H](C)NC(=O)C(F)(F)F)n1.CC(C)c1ccnc(NC[C@@H](C)NS(C)(=O)=O)n1.CC(C)c1ccnc(Nc2ccc(C(F)(F)F)cc2)n1.COCC(=O)NC[C@@H](C)Nc1nccc(C(C)C)n1.CO[C@@H](C)C(=O)NC[C@@H](C)Nc1nccc(C(C)C)n1.CO[C@@H](C)C(=O)N[C@H](C)CNc1nccc(C(C)C)n1
InChIInChI=1S/C14H14F3N3.2C14H24N4O2.C13H22N4O2.C13H20N4O.C12H17F3N4O.C12H20N4O2S.C11H20N4O2S/c1-9(2)12-7-8-18-13(20-12)19-11-5-3-10(4-6-11)14(15,16)17;1-9(2)12-6-7-15-14(18-12)16-8-10(3)17-13(19)11(4)20-5;1-9(2)12-6-7-15-14(18-12)17-10(3)8-16-13(19)11(4)20-5;1-9(2)11-5-6-14-13(17-11)16-10(3)7-15-12(18)8-19-4;1-9(2)12-4-6-14-13(16-12)15-11-5-7-17(8-11)10(3)18;1-7(2)9-4-5-16-11(19-9)17-6-8(3)18-10(20)12(13,14)15;1-9(2)11-4-6-13-12(15-11)14-10-5-7-16(8-10)19(3,17)18;1-8(2)10-5-6-12-11(14-10)13-7-9(3)15-18(4,16)17/h3-9H,1-2H3,(H,18,19,20);6-7,9-11H,8H2,1-5H3,(H,17,19)(H,15,16,18);6-7,9-11H,8H2,1-5H3,(H,16,19)(H,15,17,18);5-6,9-10H,7-8H2,1-4H3,(H,15,18)(H,14,16,17);4,6,9,11H,5,7-8H2,1-3H3,(H,14,15,16);4-5,7-8H,6H2,1-3H3,(H,18,20)(H,16,17,19);4,6,9-10H,5,7-8H2,1-3H3,(H,13,14,15);5-6,8-9,15H,7H2,1-4H3,(H,12,13,14)/t;2*10-,11+;10-;;8-;;9-/m.111.1.1/s1
InChIKeyNCOCRUGZTNYXDY-GVVVWNCOSA-N
XLogP14.34
TPSA550.43 Ų
H-Bond Donors13
H-Bond Acceptors36
Rotatable Bonds42
Heavy Atoms154
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002203.75
LogP ≤ 514.34
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1036

Analyze (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide with MolForge

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Launch Full Analysis

Related Compounds

ethane;N-(4-methyl-2-pyridinyl)-2-morpholin-4-yl-6-piperidin-3-ylpyrimidin-4-amine;N-(4-methyl-2-pyridinyl)-2-morpholin-4-yl-6-piperidin-4-ylpyrimidin-4-amine;1-[3-[2-morpholin-4-yl-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]pyrimidin-4-yl]pyrrolidin-1-yl]propan-1-one
CID 144740205
N,N-diethylethanamine;N,N-dimethylpyridin-4-amine;methanesulfonyl chloride;N-methyl-N-(1-methylsulfonylpiperidin-4-yl)-4-pyridin-3-ylimidazole-1-carboxamide;N-methyl-N-piperidin-4-yl-4-pyridin-3-ylimidazole-1-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 157640433
4-methyl-N-[4-[(4-phenylpiperazin-1-yl)sulfonylmethoxy]cyclohexyl]-3-(trifluoromethyl)aniline;2-[4-[4-methyl-3-(trifluoromethyl)anilino]cyclohexyl]oxy-1-(4-phenyl-1,4-diazepan-1-yl)ethanone;2-[4-[[5-methyl-6-(trifluoromethyl)pyrazin-2-yl]amino]cyclohexyl]oxy-1-(4-phenylpiperazin-1-yl)ethanone;2-[4-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]cyclohexyl]oxy-1-(4-phenylpiperazin-1-yl)ethanone;2-[4-[[5-methyl-6-(trifluoromethyl)-2-pyridinyl]amino]cyclohexyl]oxy-1-(4-phenylpiperazin-1-yl)ethanone;2-[4-[[6-methyl-5-(trifluoromethyl)-3-pyridinyl]amino]cyclohexyl]oxy-1-(4-phenylpiperazin-1-yl)ethanone;2-[4-[[5-methyl-4-(trifluoromethyl)pyrimidin-2-yl]amino]cyclohexyl]oxy-1-(4-phenylpiperazin-1-yl)ethanone
CID 158903026
4-[6-[6-amino-4-(trifluoromethyl)-3-pyridinyl]-2-morpholin-4-ylpyrimidin-4-yl]-N-(oxan-4-yl)morpholine-2-carboxamide;4-[6-[6-amino-4-(trifluoromethyl)-3-pyridinyl]-2-morpholin-4-ylpyrimidin-4-yl]-N-propan-2-ylmorpholine-2-carboxamide;5-[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-morpholin-4-ylpyrimidin-4-yl]-4-(trifluoromethyl)pyridin-2-amine;5-[6-[(3S)-3-fluoropyrrolidin-1-yl]-2-morpholin-4-ylpyrimidin-4-yl]-4-(trifluoromethyl)pyridin-2-amine;methane;5-[6-[(2S)-2-methylmorpholin-4-yl]-2-morpholin-4-ylpyrimidin-4-yl]-4-(trifluoromethyl)pyridin-2-amine
CID 159866650
N-[(4-methoxyphenyl)methyl]-4-propan-2-ylpyrimidin-2-amine;(2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[3-(trifluoromethoxy)phenyl]pyrimidin-2-amine;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
CID 160819238
N-benzyl-4-[(4-phenylpiperazin-1-yl)methyl]benzenesulfonamide;N-benzyl-4-[[[4-(trifluoromethyl)pyrimidin-2-yl]amino]methyl]benzenesulfonamide;N,N-dibenzyl-4-(2,5-diazabicyclo[2.2.1]heptan-2-ylmethyl)benzenesulfonamide;N,N-dibenzyl-4-[(dimethylamino)methyl]benzenesulfonamide;N,N-dibenzyl-4-[(2-morpholin-4-ylethylamino)methyl]benzenesulfonamide;N,N-dibenzyl-4-[(pyrimidin-2-ylamino)methyl]benzenesulfonamide
CID 161828701
4-(3-Fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;2-(3-fluoro-4-methylphenyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(3-fluoro-4-methylphenyl)thiazinane 1,1-dioxide;methane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;2-(4-methylphenyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(4-methylphenyl)thiazinane 1,1-dioxide;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;2-(6-methyl-3-pyridinyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(6-methyl-3-pyridinyl)thiazinane 1,1-dioxide;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one;bis(2-(2-methylpyrimidin-5-yl)thiazinane 1,1-dioxide)
CID 157069018
4-(3-Fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)pyrazin-2-one;2-(3-fluoro-4-methylphenyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(3-fluoro-4-methylphenyl)thiazinane 1,1-dioxide;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)pyrazin-2-one;2-(4-methylphenyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(4-methylphenyl)thiazinane 1,1-dioxide;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)pyrazin-2-one;2-(6-methyl-3-pyridinyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(6-methyl-3-pyridinyl)thiazinane 1,1-dioxide;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one;1-(2-methylpyrimidin-5-yl)pyrazin-2-one;2-(2-methylpyrimidin-5-yl)-1,2,6-thiadiazinane 1,1-dioxide;2-(2-methylpyrimidin-5-yl)thiazinane 1,1-dioxide
CID 157090352
1-(3-Fluoro-4-methylphenyl)-1,3-diazinan-2-one;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;2-(3-fluoro-4-methylphenyl)thiazinane 1,1-dioxide;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;2-(4-methylphenyl)thiazinane 1,1-dioxide;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;2-(6-methyl-3-pyridinyl)thiazinane 1,1-dioxide;1-(2-methylpyrimidin-5-yl)-1,3-diazinan-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one;2-(2-methylpyrimidin-5-yl)thiazinane 1,1-dioxide
CID 157630474
2-methyl-1-(4-methylpiperazin-1-yl)propan-1-one;2-methyl-N-(2-morpholin-4-ylethyl)propanamide;2-methyl-1-morpholin-4-ylpropan-1-one;2-methyl-N-(2-piperazin-1-ylethyl)propanamide;2-methyl-1-piperazin-1-ylpropan-1-one;2-methyl-N-(2-piperidin-1-ylethyl)propanamide;2-methyl-N-(piperidin-4-ylmethyl)propanamide;2-methyl-N-(pyrazin-2-ylmethyl)propanamide;2-methyl-N-(pyridin-2-ylmethyl)propanamide;bis(2-methyl-N-(pyridin-3-ylmethyl)propanamide);2-methyl-N-(pyrimidin-2-ylmethyl)propanamide;2-methyl-N-(2-pyrrolidin-1-ylethyl)propanamide;2-methyl-N-pyrrolidin-3-ylpropanamide
CID 157932122
4-(3-Fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;2-(3-fluoro-4-methylphenyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(3-fluoro-4-methylphenyl)thiazinane 1,1-dioxide;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)pyrazin-2-one;2-(4-methylphenyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(4-methylphenyl)thiazinane 1,1-dioxide;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;1-(6-methyl-3-pyridinyl)pyrazin-2-one;2-(6-methyl-3-pyridinyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(6-methyl-3-pyridinyl)thiazinane 1,1-dioxide;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one;2-(2-methylpyrimidin-5-yl)-1,2,6-thiadiazinane 1,1-dioxide;2-(2-methylpyrimidin-5-yl)thiazinane 1,1-dioxide
CID 158551975
1-(3-Fluoro-4-methylphenyl)-1,3-diazinan-2-one;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;2-(3-fluoro-4-methylphenyl)thiazinane 1,1-dioxide;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;2-(4-methylphenyl)-1,2,6-thiadiazinane 1,1-dioxide;2-(4-methylphenyl)thiazinane 1,1-dioxide;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;2-(6-methyl-3-pyridinyl)thiazinane 1,1-dioxide;1-(2-methylpyrimidin-5-yl)-1,3-diazinan-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one;2-(2-methylpyrimidin-5-yl)thiazinane 1,1-dioxide
CID 158661699

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide?
The IUPAC name of (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide (CID 159741839) is (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide.
What is the SMILES notation for (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide?
The canonical SMILES for (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide is CC(=O)N1CCC(Nc2nccc(C(C)C)n2)C1.CC(C)c1ccnc(NC2CCN(S(C)(=O)=O)C2)n1.CC(C)c1ccnc(NC[C@@H](C)NC(=O)C(F)(F)F)n1.CC(C)c1ccnc(NC[C@@H](C)NS(C)(=O)=O)n1.CC(C)c1ccnc(Nc2ccc(C(F)(F)F)cc2)n1.COCC(=O)NC[C@@H](C)Nc1nccc(C(C)C)n1.CO[C@@H](C)C(=O)NC[C@@H](C)Nc1nccc(C(C)C)n1.CO[C@@H](C)C(=O)N[C@H](C)CNc1nccc(C(C)C)n1.
What is the InChIKey of (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide?
The InChIKey is NCOCRUGZTNYXDY-GVVVWNCOSA-N. The full InChI is InChI=1S/C14H14F3N3.2C14H24N4O2.C13H22N4O2.C13H20N4O.C12H17F3N4O.C12H20N4O2S.C11H20N4O2S/c1-9(2)12-7-8-18-13(20-12)19-11-5-3-10(4-6-11)14(15,16)17;1-9(2)12-6-7-15-14(18-12)16-8-10(3)17-13(19)11(4)20-5;1-9(2)12-6-7-15-14(18-12)17-10(3)8-16-13(19)11(4)20-5;1-9(2)11-5-6-14-13(17-11)16-10(3)7-15-12(18)8-19-4;1-9(2)12-4-6-14-13(16-12)15-11-5-7-17(8-11)10(3)18;1-7(2)9-4-5-16-11(19-9)17-6-8(3)18-10(20)12(13,14)15;1-9(2)11-4-6-13-12(15-11)14-10-5-7-16(8-10)19(3,17)18;1-8(2)10-5-6-12-11(14-10)13-7-9(3)15-18(4,16)17/h3-9H,1-2H3,(H,18,19,20);6-7,9-11H,8H2,1-5H3,(H,17,19)(H,15,16,18);6-7,9-11H,8H2,1-5H3,(H,16,19)(H,15,17,18);5-6,9-10H,7-8H2,1-4H3,(H,15,18)(H,14,16,17);4,6,9,11H,5,7-8H2,1-3H3,(H,14,15,16);4-5,7-8H,6H2,1-3H3,(H,18,20)(H,16,17,19);4,6,9-10H,5,7-8H2,1-3H3,(H,13,14,15);5-6,8-9,15H,7H2,1-4H3,(H,12,13,14)/t;2*10-,11+;10-;;8-;;9-/m.111.1.1/s1.
What are the key properties of (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide?
(2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide has a molecular weight of 2203.75 g/mol, XLogP of 14.34, 42 rotatable bonds, 13 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methoxy-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]propanamide;2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]acetamide;(2S)-2-methoxy-N-[(2R)-2-[(4-propan-2-ylpyrimidin-2-yl)amino]propyl]propanamide;N-(1-methylsulfonylpyrrolidin-3-yl)-4-propan-2-ylpyrimidin-2-amine;N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]methanesulfonamide;1-[3-[(4-propan-2-ylpyrimidin-2-yl)amino]pyrrolidin-1-yl]ethanone;4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2,2,2-trifluoro-N-[(2R)-1-[(4-propan-2-ylpyrimidin-2-yl)amino]propan-2-yl]acetamide is sourced from PubChem (CID 159741839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).