N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine

C189H277N45O8 — CID 158221814

IUPACN,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine
SMILESCC(C)c1cc(N2CCN(C)CC2)ncn1.CC(C)c1cc(NCCN(C)C)ncn1.CC(C)c1cncc(N(C)CCO)n1.CC(C)c1cncc(NCCN(C)C)n1.CC(C)c1cncc(OC2CCNC2)n1.CC(C)c1nc2ccccc2[nH]1.CC(C)c1nc2ccccc2n1C.CC(C)c1nc2ccccc2n1CCN(C)C.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ncccc2[nH]1.CC(C)c1ncccn1.CC1CCN(c2cncc(C(C)C)n2)C1.CC1CCN(c2cncc(C(C)C)n2)C1.CCC(=O)Cn1c(C(C)C)nc2ccccc21.CCNc1cncc(C(C)C)n1.COC(=O)C1Cc2ccccc2N1C(C)C.COC(=O)Cn1c(C(C)C)nc2ccccc21
InChIInChI=1S/C14H21N3.C14H18N2O.C13H16N2O2.C13H17NO2.C12H20N4.2C12H19N3.2C11H20N4.C11H17N3O.C11H14N2.C10H17N3O.C10H12N2.C10H11NO.C9H11N3.C9H15N3.C7H10N2/c1-11(2)14-15-12-7-5-6-8-13(12)17(14)10-9-16(3)4;1-4-11(17)9-16-13-8-6-5-7-12(13)15-14(16)10(2)3;1-9(2)13-14-10-6-4-5-7-11(10)15(13)8-12(16)17-3;1-9(2)14-11-7-5-4-6-10(11)8-12(14)13(15)16-3;1-10(2)11-8-12(14-9-13-11)16-6-4-15(3)5-7-16;2*1-9(2)11-6-13-7-12(14-11)15-5-4-10(3)8-15;1-9(2)10-7-12-8-11(14-10)13-5-6-15(3)4;1-9(2)10-7-11(14-8-13-10)12-5-6-15(3)4;1-8(2)10-6-13-7-11(14-10)15-9-3-4-12-5-9;1-8(2)11-12-9-6-4-5-7-10(9)13(11)3;1-8(2)9-6-11-7-10(12-9)13(3)4-5-14;2*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-4-11-9-6-10-5-8(12-9)7(2)3;1-6(2)7-8-4-3-5-9-7/h5-8,11H,9-10H2,1-4H3;5-8,10H,4,9H2,1-3H3;4-7,9H,8H2,1-3H3;4-7,9,12H,8H2,1-3H3;8-10H,4-7H2,1-3H3;2*6-7,9-10H,4-5,8H2,1-3H3;7-9H,5-6H2,1-4H3,(H,13,14);7-9H,5-6H2,1-4H3,(H,12,13,14);6-9,12H,3-5H2,1-2H3;4-8H,1-3H3;6-8,14H,4-5H2,1-3H3;3-7H,1-2H3,(H,11,12);3-7H,1-2H3;3-6H,1-2H3,(H,10,11,12);5-7H,4H2,1-3H3,(H,11,12);3-6H,1-2H3
InChIKeyGDIHJGXGRVRXJP-UHFFFAOYSA-N
MW3307.60 g/mol
LogP36.00
Rot. Bonds44

About N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine

N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine (PubChem CID 158221814) has the molecular formula C189H277N45O8 and a molecular weight of 3307.60 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine
PubChem CID158221814
Molecular FormulaC189H277N45O8
Molecular Weight3307.60 g/mol
Exact Mass3305.27
IUPAC NameN,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine
SMILESCC(C)c1cc(N2CCN(C)CC2)ncn1.CC(C)c1cc(NCCN(C)C)ncn1.CC(C)c1cncc(N(C)CCO)n1.CC(C)c1cncc(NCCN(C)C)n1.CC(C)c1cncc(OC2CCNC2)n1.CC(C)c1nc2ccccc2[nH]1.CC(C)c1nc2ccccc2n1C.CC(C)c1nc2ccccc2n1CCN(C)C.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ncccc2[nH]1.CC(C)c1ncccn1.CC1CCN(c2cncc(C(C)C)n2)C1.CC1CCN(c2cncc(C(C)C)n2)C1.CCC(=O)Cn1c(C(C)C)nc2ccccc21.CCNc1cncc(C(C)C)n1.COC(=O)C1Cc2ccccc2N1C(C)C.COC(=O)Cn1c(C(C)C)nc2ccccc21
InChIInChI=1S/C14H21N3.C14H18N2O.C13H16N2O2.C13H17NO2.C12H20N4.2C12H19N3.2C11H20N4.C11H17N3O.C11H14N2.C10H17N3O.C10H12N2.C10H11NO.C9H11N3.C9H15N3.C7H10N2/c1-11(2)14-15-12-7-5-6-8-13(12)17(14)10-9-16(3)4;1-4-11(17)9-16-13-8-6-5-7-12(13)15-14(16)10(2)3;1-9(2)13-14-10-6-4-5-7-11(10)15(13)8-12(16)17-3;1-9(2)14-11-7-5-4-6-10(11)8-12(14)13(15)16-3;1-10(2)11-8-12(14-9-13-11)16-6-4-15(3)5-7-16;2*1-9(2)11-6-13-7-12(14-11)15-5-4-10(3)8-15;1-9(2)10-7-12-8-11(14-10)13-5-6-15(3)4;1-9(2)10-7-11(14-8-13-10)12-5-6-15(3)4;1-8(2)10-6-13-7-11(14-10)15-9-3-4-12-5-9;1-8(2)11-12-9-6-4-5-7-10(9)13(11)3;1-8(2)9-6-11-7-10(12-9)13(3)4-5-14;2*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-4-11-9-6-10-5-8(12-9)7(2)3;1-6(2)7-8-4-3-5-9-7/h5-8,11H,9-10H2,1-4H3;5-8,10H,4,9H2,1-3H3;4-7,9H,8H2,1-3H3;4-7,9,12H,8H2,1-3H3;8-10H,4-7H2,1-3H3;2*6-7,9-10H,4-5,8H2,1-3H3;7-9H,5-6H2,1-4H3,(H,13,14);7-9H,5-6H2,1-4H3,(H,12,13,14);6-9,12H,3-5H2,1-2H3;4-8H,1-3H3;6-8,14H,4-5H2,1-3H3;3-7H,1-2H3,(H,11,12);3-7H,1-2H3;3-6H,1-2H3,(H,10,11,12);5-7H,4H2,1-3H3,(H,11,12);3-6H,1-2H3
InChIKeyGDIHJGXGRVRXJP-UHFFFAOYSA-N
XLogP36.00
TPSA575.99 Ų
H-Bond Donors7
H-Bond Acceptors51
Rotatable Bonds44
Heavy Atoms242
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003307.60
LogP ≤ 536.00
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1051

Analyze N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine 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

US11053243, Example 213
CID 67949560
3-tert-butyl-N-hydroxy-N-methyl-1,2,4-oxadiazole-5-carboxamide;3-tert-butyl-1,2,4-oxadiazole-5-carboxamide;N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)acetamide;ethyl 3-tert-butyl-1,2,4-oxadiazole-5-carboxylate;N-hydroxy-4-methyl-1,3-oxazole-2-carboxamide;N-methoxy-4-methyl-1,3-oxazole-2-carboxamide;6-methyl-2-(4-methylphenyl)-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyridine;5-propan-2-yl-3-pyridin-2-yl-1,2,4-oxadiazole;2-propan-2-yl-6-(trifluoromethyl)-3H-indole
CID 157695067
3-methoxy-N-methyl-4-[[4-propan-2-yloxy-5-[4-(1H-pyrrol-2-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide;N-methyl-4-[[5-(2-methyl-1,3-benzoxazol-6-yl)-4-(oxan-4-yloxy)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-(2,2,2-trifluoroethyl)benzamide;N-methyl-4-[[5-(2-methyl-1,3-benzoxazol-6-yl)-4-(oxan-4-yloxy)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-(trifluoromethyl)benzamide
CID 157850428
8-tert-butyl-2-(2-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridine;3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)phenol;8-tert-butyl-2-(1H-indol-3-yl)imidazo[1,2-a]pyridine;7-tert-butyl-2-(4-methoxyphenyl)-1,3-benzoxazole;5-tert-butyl-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine;7-tert-butyl-2-pyridin-3-yl-1,3-benzoxazole;8-tert-butyl-2-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridine
CID 157894266
12-[(4,4-difluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;12-[(4-fluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-6,12-dimorpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-11-methyl-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158180516
12-[(4,4-difluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;12-[(4-fluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-12-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-11-methyl-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158885713
2-(1,3-benzoxazol-7-yl)-N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-7-yl)-N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropylethyl)-2-(6-cyclopropyloxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-ethyl-2-(2-oxo-3-propan-2-ylimidazolidin-1-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(3-fluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(3-fluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(3-methoxyphenyl)-4-methyl-N-[(2R)-1,1,1-trifluoropropan-2-yl]imidazo[1,5-a]pyrimidine-8-carboxamide
CID 158900408
1H-benzimidazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzoxazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;imidazo[1,2-b]pyridazin-6-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-imidazo[4,5-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-indol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 159543739
[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(1H-imidazol-2-yl)methanone;4-[8-amino-1-[7-(trifluoromethoxy)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]-N-(6-methyl-3-pyridinyl)cyclohexane-1-carboxamide;methyl 4-[8-amino-1-(7-fluoro-1-methylindol-6-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylate
CID 159889153
12-[4-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]phenyl]-4-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;12-[3-methoxy-4-(piperidin-1-ylmethyl)phenyl]-4-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;12-[4-[(4-methoxypiperidin-1-yl)methyl]phenyl]-4-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;4-[[4-[4-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-12-yl]phenyl]methyl]morpholine;4-(1-methylpyrazol-4-yl)-12-[4-[[4-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;5-[12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-4-yl]-1,3-oxazole
CID 159941433
N-[(1S)-1-cyclopropylethyl]-2-(3-fluoro-2-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-2-(3-fluoro-2-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-[3-(1,3-oxazol-2-yl)phenyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(3-pyrimidin-2-ylphenyl)imidazo[1,5-a]pyrimidine-8-carboxamide;2-(3-fluoro-5-methoxyphenyl)-4-methyl-N-(1,1,1-trifluoropropan-2-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;2-(3-fluoro-5-methoxyphenyl)-4-methyl-N-[(2R)-1,1,1-trifluoropropan-2-yl]imidazo[1,5-a]pyrimidine-8-carboxamide;2-(3-fluoro-5-methoxyphenyl)-4-methyl-N-[(2S)-1,1,1-trifluoropropan-2-yl]imidazo[1,5-a]pyrimidine-8-carboxamide
CID 160060668
4-[[1-(1H-benzimidazol-2-ylmethyl)benzimidazol-2-yl]methyl]morpholine;[4-[[1-(1H-benzimidazol-2-ylmethyl)benzimidazol-2-yl]methyl]piperazin-1-yl]-(furan-2-yl)methanone;1-(1H-benzimidazol-2-ylmethyl)-2-(2,5-dihydropyrrol-1-ylmethyl)benzimidazole;1-(1H-benzimidazol-2-ylmethyl)-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]benzimidazole;methyl 3-(1H-benzimidazol-2-ylmethyl)-2-(morpholin-4-ylmethyl)benzimidazole-5-carboxylate
CID 160351649

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine?
The IUPAC name of N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine (CID 158221814) is N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine.
What is the SMILES notation for N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine?
The canonical SMILES for N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine is CC(C)c1cc(N2CCN(C)CC2)ncn1.CC(C)c1cc(NCCN(C)C)ncn1.CC(C)c1cncc(N(C)CCO)n1.CC(C)c1cncc(NCCN(C)C)n1.CC(C)c1cncc(OC2CCNC2)n1.CC(C)c1nc2ccccc2[nH]1.CC(C)c1nc2ccccc2n1C.CC(C)c1nc2ccccc2n1CCN(C)C.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ncccc2[nH]1.CC(C)c1ncccn1.CC1CCN(c2cncc(C(C)C)n2)C1.CC1CCN(c2cncc(C(C)C)n2)C1.CCC(=O)Cn1c(C(C)C)nc2ccccc21.CCNc1cncc(C(C)C)n1.COC(=O)C1Cc2ccccc2N1C(C)C.COC(=O)Cn1c(C(C)C)nc2ccccc21.
What is the InChIKey of N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine?
The InChIKey is GDIHJGXGRVRXJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3.C14H18N2O.C13H16N2O2.C13H17NO2.C12H20N4.2C12H19N3.2C11H20N4.C11H17N3O.C11H14N2.C10H17N3O.C10H12N2.C10H11NO.C9H11N3.C9H15N3.C7H10N2/c1-11(2)14-15-12-7-5-6-8-13(12)17(14)10-9-16(3)4;1-4-11(17)9-16-13-8-6-5-7-12(13)15-14(16)10(2)3;1-9(2)13-14-10-6-4-5-7-11(10)15(13)8-12(16)17-3;1-9(2)14-11-7-5-4-6-10(11)8-12(14)13(15)16-3;1-10(2)11-8-12(14-9-13-11)16-6-4-15(3)5-7-16;2*1-9(2)11-6-13-7-12(14-11)15-5-4-10(3)8-15;1-9(2)10-7-12-8-11(14-10)13-5-6-15(3)4;1-9(2)10-7-11(14-8-13-10)12-5-6-15(3)4;1-8(2)10-6-13-7-11(14-10)15-9-3-4-12-5-9;1-8(2)11-12-9-6-4-5-7-10(9)13(11)3;1-8(2)9-6-11-7-10(12-9)13(3)4-5-14;2*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-4-11-9-6-10-5-8(12-9)7(2)3;1-6(2)7-8-4-3-5-9-7/h5-8,11H,9-10H2,1-4H3;5-8,10H,4,9H2,1-3H3;4-7,9H,8H2,1-3H3;4-7,9,12H,8H2,1-3H3;8-10H,4-7H2,1-3H3;2*6-7,9-10H,4-5,8H2,1-3H3;7-9H,5-6H2,1-4H3,(H,13,14);7-9H,5-6H2,1-4H3,(H,12,13,14);6-9,12H,3-5H2,1-2H3;4-8H,1-3H3;6-8,14H,4-5H2,1-3H3;3-7H,1-2H3,(H,11,12);3-7H,1-2H3;3-6H,1-2H3,(H,10,11,12);5-7H,4H2,1-3H3,(H,11,12);3-6H,1-2H3.
What are the key properties of N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine?
N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine has a molecular weight of 3307.60 g/mol, XLogP of 36.00, 44 rotatable bonds, 7 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-propan-2-ylbenzimidazol-1-yl)ethanamine;N',N'-dimethyl-N-(6-propan-2-ylpyrazin-2-yl)ethane-1,2-diamine;N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine;N-ethyl-6-propan-2-ylpyrazin-2-amine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;1-methyl-2-propan-2-ylbenzimidazole;methyl 2-(2-propan-2-ylbenzimidazol-1-yl)acetate;methyl 1-propan-2-yl-2,3-dihydroindole-2-carboxylate;2-[methyl-(6-propan-2-ylpyrazin-2-yl)amino]ethanol;bis(2-(3-methylpyrrolidin-1-yl)-6-propan-2-ylpyrazine);2-propan-2-yl-1H-benzimidazole;1-(2-propan-2-ylbenzimidazol-1-yl)butan-2-one;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-3-yloxypyrazine is sourced from PubChem (CID 158221814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).