5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane

C141H183F5N34O2 — CID 160777806

IUPAC5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane
SMILESCCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.CCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.COCCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.Cc1cc(-c2cn(C3[C@H]4CN(C5CCOCC5)C[C@@H]34)c(CC3CC3)n2)cnc1N.Cc1cc(-c2cn(C3[C@H]4CN(CCF)C[C@@H]34)c(CC3CC3)n2)cnc1N.Cc1cc(-c2cn(C3[C@H]4CNC[C@@H]34)c(C3CC3)n2)cnc1N.Cc1ncc(-c2cn(C3[C@H]4CN(CCF)C[C@@H]34)c(C3CC3)n2)cc1C(F)(F)F
InChIInChI=1S/C23H31N5O.C21H29N5O.C20H22F4N4.C20H26FN5.2C20H27N5.C17H21N5/c1-14-8-16(10-25-23(14)24)20-13-28(21(26-20)9-15-2-3-15)22-18-11-27(12-19(18)22)17-4-6-29-7-5-17;1-13-7-15(9-23-21(13)22)18-12-26(19(24-18)8-14-3-4-14)20-16-10-25(5-6-27-2)11-17(16)20;1-11-16(20(22,23)24)6-13(7-25-11)17-10-28(19(26-17)12-2-3-12)18-14-8-27(5-4-21)9-15(14)18;1-12-6-14(8-23-20(12)22)17-11-26(18(24-17)7-13-2-3-13)19-15-9-25(5-4-21)10-16(15)19;2*1-3-24-9-15-16(10-24)19(15)25-11-17(23-18(25)7-13-4-5-13)14-6-12(2)20(21)22-8-14;1-9-4-11(5-20-16(9)18)14-8-22(17(21-14)10-2-3-10)15-12-6-19-7-13(12)15/h8,10,13,15,17-19,22H,2-7,9,11-12H2,1H3,(H2,24,25);7,9,12,14,16-17,20H,3-6,8,10-11H2,1-2H3,(H2,22,23);6-7,10,12,14-15,18H,2-5,8-9H2,1H3;6,8,11,13,15-16,19H,2-5,7,9-10H2,1H3,(H2,22,23);2*6,8,11,13,15-16,19H,3-5,7,9-10H2,1-2H3,(H2,21,22);4-5,8,10,12-13,15,19H,2-3,6-7H2,1H3,(H2,18,20)/t18-,19+,22?;16-,17+,20?;14-,15+,18?;3*15-,16+,19?;12-,13+,15?
InChIKeySAEHZPFYKTUGRP-GQLNPBNTSA-N
MW2481.24 g/mol
LogP20.61
Rot. Bonds36

About 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane

5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane (PubChem CID 160777806) has the molecular formula C141H183F5N34O2 and a molecular weight of 2481.24 g/mol. Its IUPAC name is 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane.

Molecular Properties

Compound Name5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane
PubChem CID160777806
Molecular FormulaC141H183F5N34O2
Molecular Weight2481.24 g/mol
Exact Mass2479.52
IUPAC Name5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane
SMILESCCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.CCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.COCCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.Cc1cc(-c2cn(C3[C@H]4CN(C5CCOCC5)C[C@@H]34)c(CC3CC3)n2)cnc1N.Cc1cc(-c2cn(C3[C@H]4CN(CCF)C[C@@H]34)c(CC3CC3)n2)cnc1N.Cc1cc(-c2cn(C3[C@H]4CNC[C@@H]34)c(C3CC3)n2)cnc1N.Cc1ncc(-c2cn(C3[C@H]4CN(CCF)C[C@@H]34)c(C3CC3)n2)cc1C(F)(F)F
InChIInChI=1S/C23H31N5O.C21H29N5O.C20H22F4N4.C20H26FN5.2C20H27N5.C17H21N5/c1-14-8-16(10-25-23(14)24)20-13-28(21(26-20)9-15-2-3-15)22-18-11-27(12-19(18)22)17-4-6-29-7-5-17;1-13-7-15(9-23-21(13)22)18-12-26(19(24-18)8-14-3-4-14)20-16-10-25(5-6-27-2)11-17(16)20;1-11-16(20(22,23)24)6-13(7-25-11)17-10-28(19(26-17)12-2-3-12)18-14-8-27(5-4-21)9-15(14)18;1-12-6-14(8-23-20(12)22)17-11-26(18(24-17)7-13-2-3-13)19-15-9-25(5-4-21)10-16(15)19;2*1-3-24-9-15-16(10-24)19(15)25-11-17(23-18(25)7-13-4-5-13)14-6-12(2)20(21)22-8-14;1-9-4-11(5-20-16(9)18)14-8-22(17(21-14)10-2-3-10)15-12-6-19-7-13(12)15/h8,10,13,15,17-19,22H,2-7,9,11-12H2,1H3,(H2,24,25);7,9,12,14,16-17,20H,3-6,8,10-11H2,1-2H3,(H2,22,23);6-7,10,12,14-15,18H,2-5,8-9H2,1H3;6,8,11,13,15-16,19H,2-5,7,9-10H2,1H3,(H2,22,23);2*6,8,11,13,15-16,19H,3-5,7,9-10H2,1-2H3,(H2,21,22);4-5,8,10,12-13,15,19H,2-3,6-7H2,1H3,(H2,18,20)/t18-,19+,22?;16-,17+,20?;14-,15+,18?;3*15-,16+,19?;12-,13+,15?
InChIKeySAEHZPFYKTUGRP-GQLNPBNTSA-N
XLogP20.61
TPSA421.02 Ų
H-Bond Donors7
H-Bond Acceptors36
Rotatable Bonds36
Heavy Atoms182
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002481.24
LogP ≤ 520.61
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1036

Analyze 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane with MolForge

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Related Compounds

2-(3,3-difluoroazetidin-1-yl)-N-[6-[5-[[3-[2-(3,3-difluoroazetidin-1-yl)-6-[[6-[4-[[3-[2-(3,3-difluoroazetidin-1-yl)-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]pyrimidin-4-yl]pyrrolidin-1-yl]methyl]imidazol-1-yl]-4-(trifluoromethyl)-2-pyridinyl]amino]pyrimidin-4-yl]pyrrolidin-1-yl]methyl]pyrimidin-2-yl]-4-(trifluoromethyl)-2-pyridinyl]-6-[1-(oxolan-3-ylmethyl)pyrrolidin-3-yl]pyrimidin-4-amine
CID 123895331
3-Methoxy-1-[3-[2-[1-[3-[2-[2-[[1-methyl-4-[2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]pyrimidin-4-yl]piperidin-2-yl]methyl]pyrrolidin-1-yl]-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethyl]-6-[(4-methyl-2-pyridinyl)amino]pyrimidin-4-yl]piperidin-1-yl]propan-1-one
CID 123965268
6-(1-aminoheptan-3-yl)-2-morpholin-4-yl-N-[4-(trifluoromethyl)-2-pyridinyl]pyrimidin-4-amine;6-[1-[(E)-but-2-en-2-yl]piperidin-3-yl]-2-propan-2-yl-N-[4-(trifluoromethyl)-2-pyridinyl]pyrimidin-4-amine;2-[(2R)-2-methylpyrrolidin-1-yl]-6-piperidin-4-yl-N-[4-(trifluoromethyl)-2-pyridinyl]pyrimidin-4-amine
CID 144740142
1-[3-[2-[1-[3-[2-(2,3-dimethylpyrrolidin-1-yl)-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethyl]-6-[(4-methyl-2-pyridinyl)amino]pyrimidin-4-yl]piperidin-1-yl]-3-methoxypropan-1-one;ethane;2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)-6-piperidin-4-yl-N-[4-(trifluoromethyl)-2-pyridinyl]pyrimidin-4-amine
CID 144740160
ethane;2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)-6-piperidin-4-yl-N-[4-(trifluoromethyl)-2-pyridinyl]pyrimidin-4-amine;1-[4-[2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]pyrimidin-4-yl]piperidin-1-yl]ethanone
CID 144740256
Ethane;3-(2-piperazin-1-ylpyrimidin-4-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;3-(2-piperidin-1-ylpyrimidin-4-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;4-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]morpholine
CID 157063868
2-[4-(3,6-dihydro-2H-pyran-4-yl)-2,5-dimethylimidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[4-(3,6-dihydro-2H-pyran-4-yl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[4-(3,6-dihydro-2H-pyran-4-yl)-2-methylimidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[4-(3,6-dihydro-2H-pyran-4-yl)-5-methylimidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(oxan-4-yl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(oxan-4-yl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide
CID 157152889
1-[1-cyclobutyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-2-yl]propan-1-ol;bis(5-[1-(3-fluorocyclobutyl)-2-propan-2-ylimidazol-4-yl]-2-methyl-3-(trifluoromethyl)pyridine);2-methyl-5-(1-methyl-2-propan-2-ylimidazol-4-yl)-3-(trifluoromethyl)pyridine;2-methyl-5-[1-(2-oxaspiro[3.3]heptan-6-yl)-2-propan-2-ylimidazol-4-yl]-3-(trifluoromethyl)pyridine;bis(3-methyl-5-[1-[(1R,5S)-3-(1,4-oxazepan-4-yl)-6-bicyclo[3.1.0]hexanyl]-2-propan-2-ylimidazol-4-yl]pyridin-2-amine)
CID 157163616
5-[2-Cyclobutyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-cyclopentyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-ethyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;bis(3-methyl-5-[2-(2-methylpropyl)-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]pyridin-2-amine);4-[3-[2-(2-methylpropyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]morpholine
CID 157320784
1-[4-(6-Amino-5-methyl-3-pyridinyl)-1-(1-bicyclo[1.1.1]pentanyl)imidazol-2-yl]ethanol;bis(5-[2-(cyclopropylmethyl)-1-[3-(4-methylpiperazin-1-yl)-1-bicyclo[1.1.1]pentanyl]imidazol-4-yl]-3-methylpyridin-2-amine);bis(5-[2-cyclopropyl-1-[3-(4-methylpiperazin-1-yl)-1-bicyclo[1.1.1]pentanyl]imidazol-4-yl]-3-methylpyridin-2-amine);1-[3-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]-4-methylpiperazine;3-methyl-5-[1-[3-(4-methylpiperazin-1-yl)-1-bicyclo[1.1.1]pentanyl]-2-propan-2-ylimidazol-4-yl]pyridin-2-amine
CID 157428003
1-[3-[4-(6-Amino-5-methyl-3-pyridinyl)-2-cyclopropylimidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]-4-methylpiperazin-2-one;4-[3-[4-(6-amino-5-methyl-3-pyridinyl)-2-cyclopropylimidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]-1-methylpiperazin-2-one;1-[3-[4-(6-amino-5-methyl-3-pyridinyl)-2-cyclopropylimidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]piperidin-4-ol;5-[1-[3-[bis(2-methoxyethyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;5-[2-cyclopropyl-1-[3-(4,4-difluoropiperidin-1-yl)-1-bicyclo[1.1.1]pentanyl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-cyclopropyl-1-[3-[2-methoxyethyl(methyl)amino]-1-bicyclo[1.1.1]pentanyl]imidazol-4-yl]-3-methylpyridin-2-amine
CID 157563367
6,6-dimethyl-4-morpholin-4-yl-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)-8,9-dihydropurino[8,9-c][1,4]oxazine;4-[2-(6-methyl-3-pyridinyl)-6,7,8,9-tetrahydropurino[9,8-a]pyridin-4-yl]morpholine;4-[2-(2-methylpyrimidin-5-yl)-7,8-dihydro-6H-purino[9,8-a]pyrrol-4-yl]morpholine;4-[2-(2-methylpyrimidin-5-yl)-6,7,8,9-tetrahydropurino[9,8-a]pyridin-4-yl]morpholine;2-[6-methyl-4-(trifluoromethyl)-3-pyridinyl]-4-morpholin-4-yl-8,9-dihydro-6H-purino[8,9-c][1,4]oxazine
CID 157587753

Frequently Asked Questions

What is the IUPAC name of 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane?
The IUPAC name of 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane (CID 160777806) is 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane.
What is the SMILES notation for 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane?
The canonical SMILES for 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane is CCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.CCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.COCCN1C[C@@H]2C(n3cc(-c4cnc(N)c(C)c4)nc3CC3CC3)[C@@H]2C1.Cc1cc(-c2cn(C3[C@H]4CN(C5CCOCC5)C[C@@H]34)c(CC3CC3)n2)cnc1N.Cc1cc(-c2cn(C3[C@H]4CN(CCF)C[C@@H]34)c(CC3CC3)n2)cnc1N.Cc1cc(-c2cn(C3[C@H]4CNC[C@@H]34)c(C3CC3)n2)cnc1N.Cc1ncc(-c2cn(C3[C@H]4CN(CCF)C[C@@H]34)c(C3CC3)n2)cc1C(F)(F)F.
What is the InChIKey of 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane?
The InChIKey is SAEHZPFYKTUGRP-GQLNPBNTSA-N. The full InChI is InChI=1S/C23H31N5O.C21H29N5O.C20H22F4N4.C20H26FN5.2C20H27N5.C17H21N5/c1-14-8-16(10-25-23(14)24)20-13-28(21(26-20)9-15-2-3-15)22-18-11-27(12-19(18)22)17-4-6-29-7-5-17;1-13-7-15(9-23-21(13)22)18-12-26(19(24-18)8-14-3-4-14)20-16-10-25(5-6-27-2)11-17(16)20;1-11-16(20(22,23)24)6-13(7-25-11)17-10-28(19(26-17)12-2-3-12)18-14-8-27(5-4-21)9-15(14)18;1-12-6-14(8-23-20(12)22)17-11-26(18(24-17)7-13-2-3-13)19-15-9-25(5-4-21)10-16(15)19;2*1-3-24-9-15-16(10-24)19(15)25-11-17(23-18(25)7-13-4-5-13)14-6-12(2)20(21)22-8-14;1-9-4-11(5-20-16(9)18)14-8-22(17(21-14)10-2-3-10)15-12-6-19-7-13(12)15/h8,10,13,15,17-19,22H,2-7,9,11-12H2,1H3,(H2,24,25);7,9,12,14,16-17,20H,3-6,8,10-11H2,1-2H3,(H2,22,23);6-7,10,12,14-15,18H,2-5,8-9H2,1H3;6,8,11,13,15-16,19H,2-5,7,9-10H2,1H3,(H2,22,23);2*6,8,11,13,15-16,19H,3-5,7,9-10H2,1-2H3,(H2,21,22);4-5,8,10,12-13,15,19H,2-3,6-7H2,1H3,(H2,18,20)/t18-,19+,22?;16-,17+,20?;14-,15+,18?;3*15-,16+,19?;12-,13+,15?.
What are the key properties of 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane?
5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane has a molecular weight of 2481.24 g/mol, XLogP of 20.61, 36 rotatable bonds, 7 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-cyclopropylimidazol-4-yl]-3-methylpyridin-2-amine;bis(5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-ethyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine);5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1R,5S)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-(cyclopropylmethyl)-1-[(1S,5R)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]imidazol-4-yl]-3-methylpyridin-2-amine;(1S,5R)-6-[2-cyclopropyl-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-3-(2-fluoroethyl)-3-azabicyclo[3.1.0]hexane is sourced from PubChem (CID 160777806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).