N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]

C179H188N26O10S — CID 157155466

IUPACN,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
SMILESCC1=NC2(CCc3ccc(-c4ccccn4)cc3C2)CO1.CC1=NC2(CCc3ccc(-c4cccnc4C)cc3C2)CO1.CC1=NC2(CCc3ccc(-c4ccnn4C)cc3C2)CO1.CC1=N[C@@]2(CCc3c(cccc3-c3cncnc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3ccccc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cnc(N(C)C)nc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cncc(C)c3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cncnc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cscn3)C2)CO1.CNc1ncncc1-c1ccc2c(c1)C[C@]1(CC2)COC(C)=N1
InChIInChI=1S/C19H22N4O.2C19H20N2O.C19H19NO.C18H20N4O.C18H18N2O.C17H19N3O.2C17H17N3O.C16H16N2OS/c1-13-22-19(12-24-13)8-7-17-14(9-19)5-4-6-16(17)15-10-20-18(21-11-15)23(2)3;1-13-18(4-3-9-20-13)16-6-5-15-7-8-19(11-17(15)10-16)12-22-14(2)21-19;1-13-8-16(11-20-10-13)17-5-3-4-15-9-19(7-6-18(15)17)12-22-14(2)21-19;1-14-20-19(13-21-14)11-10-18-16(12-19)8-5-9-17(18)15-6-3-2-4-7-15;1-12-22-18(10-23-12)6-5-13-3-4-14(7-15(13)8-18)16-9-20-11-21-17(16)19-2;1-13-20-18(12-21-13)8-7-14-5-6-15(10-16(14)11-18)17-4-2-3-9-19-17;1-12-19-17(11-21-12)7-5-13-3-4-14(9-15(13)10-17)16-6-8-18-20(16)2;2*1-12-20-17(10-21-12)6-5-16-13(7-17)3-2-4-15(16)14-8-18-11-19-9-14;1-11-18-16(9-19-11)6-5-13-12(7-16)3-2-4-14(13)15-8-20-10-17-15/h4-6,10-11H,7-9,12H2,1-3H3;3-6,9-10H,7-8,11-12H2,1-2H3;3-5,8,10-11H,6-7,9,12H2,1-2H3;2-9H,10-13H2,1H3;3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,19,20,21);2-6,9-10H,7-8,11-12H2,1H3;3-4,6,8-9H,5,7,10-11H2,1-2H3;2*2-4,8-9,11H,5-7,10H2,1H3;2-4,8,10H,5-7,9H2,1H3/t19-;;2*19-;18-;;;2*17-;16-/m0.001..100/s1
InChIKeyALTGGIWBQSQOEM-XEPIXSQXSA-N
MW2895.71 g/mol
LogP32.56
Rot. Bonds12

About N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]

N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] (PubChem CID 157155466) has the molecular formula C179H188N26O10S and a molecular weight of 2895.71 g/mol. Its IUPAC name is N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole].

Molecular Properties

Compound NameN,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
PubChem CID157155466
Molecular FormulaC179H188N26O10S
Molecular Weight2895.71 g/mol
Exact Mass2893.47
IUPAC NameN,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
SMILESCC1=NC2(CCc3ccc(-c4ccccn4)cc3C2)CO1.CC1=NC2(CCc3ccc(-c4cccnc4C)cc3C2)CO1.CC1=NC2(CCc3ccc(-c4ccnn4C)cc3C2)CO1.CC1=N[C@@]2(CCc3c(cccc3-c3cncnc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3ccccc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cnc(N(C)C)nc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cncc(C)c3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cncnc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cscn3)C2)CO1.CNc1ncncc1-c1ccc2c(c1)C[C@]1(CC2)COC(C)=N1
InChIInChI=1S/C19H22N4O.2C19H20N2O.C19H19NO.C18H20N4O.C18H18N2O.C17H19N3O.2C17H17N3O.C16H16N2OS/c1-13-22-19(12-24-13)8-7-17-14(9-19)5-4-6-16(17)15-10-20-18(21-11-15)23(2)3;1-13-18(4-3-9-20-13)16-6-5-15-7-8-19(11-17(15)10-16)12-22-14(2)21-19;1-13-8-16(11-20-10-13)17-5-3-4-15-9-19(7-6-18(15)17)12-22-14(2)21-19;1-14-20-19(13-21-14)11-10-18-16(12-19)8-5-9-17(18)15-6-3-2-4-7-15;1-12-22-18(10-23-12)6-5-13-3-4-14(7-15(13)8-18)16-9-20-11-21-17(16)19-2;1-13-20-18(12-21-13)8-7-14-5-6-15(10-16(14)11-18)17-4-2-3-9-19-17;1-12-19-17(11-21-12)7-5-13-3-4-14(9-15(13)10-17)16-6-8-18-20(16)2;2*1-12-20-17(10-21-12)6-5-16-13(7-17)3-2-4-15(16)14-8-18-11-19-9-14;1-11-18-16(9-19-11)6-5-13-12(7-16)3-2-4-14(13)15-8-20-10-17-15/h4-6,10-11H,7-9,12H2,1-3H3;3-6,9-10H,7-8,11-12H2,1-2H3;3-5,8,10-11H,6-7,9,12H2,1-2H3;2-9H,10-13H2,1H3;3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,19,20,21);2-6,9-10H,7-8,11-12H2,1H3;3-4,6,8-9H,5,7,10-11H2,1-2H3;2*2-4,8-9,11H,5-7,10H2,1H3;2-4,8,10H,5-7,9H2,1H3/t19-;;2*19-;18-;;;2*17-;16-/m0.001..100/s1
InChIKeyALTGGIWBQSQOEM-XEPIXSQXSA-N
XLogP32.56
TPSA403.67 Ų
H-Bond Donors1
H-Bond Acceptors37
Rotatable Bonds12
Heavy Atoms216
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002895.71
LogP ≤ 532.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1037

Analyze N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] with MolForge

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Related Compounds

8-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];methane;5-(6-methoxypyrazin-2-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-(2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl)pyrimidin-4-amine;2'-methyl-5-pyrazin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
CID 158597587
2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
CID 58466946
5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
CID 159521344
2'-methyl-8-(6-methylpyrazin-2-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
CID 58466941
[(2S)-2-amino-5-bromo-3,4-dihydro-1H-naphthalen-2-yl]methanol;(3S)-8-bromo-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];1,1,1-trimethoxyethane
CID 159029419
2',3'-dimethyl-4-pyrimidin-5-ylspiro[1,3-dihydroindene-2,5'-4H-imidazole];(3S)-3'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]-2'-amine;3'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole];4-(5-methylspiro[3,4-dihydropyrrole-2,7'-6,8-dihydro-5H-naphthalene]-1'-yl)-1,3-thiazole
CID 158239620
(5S)-8'-(1-benzofuran-2-yl)-2-methylspiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene];(3S)-2',3'-dimethyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole];(3S)-8-(2-fluoro-4-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]-2'-amine;(5S)-8'-(furan-3-yl)-2-methylspiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene];(3S)-2'-methyl-8-(4-phenylphenyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(5S)-2-methyl-8'-pyridin-3-ylspiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene];(5S)-2-methyl-8'-pyridin-4-ylspiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene];(5S)-2-methyl-8'-thiophen-2-ylspiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]
CID 158227330
(3S)-5-methoxy-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
CID 58467047
2',3'-dimethyl-8-thiophen-3-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]
CID 70228450
2-methyl-3-(4-phenylphenyl)pyridine
CID 90167639
5-(3,5-dimethyl-1H-pyrazol-4-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
CID 58466609
3-methyl-8'-pyrimidin-5-ylspiro[1,3-oxazolidine-4,3'-2,4-dihydro-1H-naphthalene]-2-imine
CID 58466567

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]?
The IUPAC name of N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] (CID 157155466) is N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole].
What is the SMILES notation for N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]?
The canonical SMILES for N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] is CC1=NC2(CCc3ccc(-c4ccccn4)cc3C2)CO1.CC1=NC2(CCc3ccc(-c4cccnc4C)cc3C2)CO1.CC1=NC2(CCc3ccc(-c4ccnn4C)cc3C2)CO1.CC1=N[C@@]2(CCc3c(cccc3-c3cncnc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3ccccc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cnc(N(C)C)nc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cncc(C)c3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cncnc3)C2)CO1.CC1=N[C@]2(CCc3c(cccc3-c3cscn3)C2)CO1.CNc1ncncc1-c1ccc2c(c1)C[C@]1(CC2)COC(C)=N1.
What is the InChIKey of N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]?
The InChIKey is ALTGGIWBQSQOEM-XEPIXSQXSA-N. The full InChI is InChI=1S/C19H22N4O.2C19H20N2O.C19H19NO.C18H20N4O.C18H18N2O.C17H19N3O.2C17H17N3O.C16H16N2OS/c1-13-22-19(12-24-13)8-7-17-14(9-19)5-4-6-16(17)15-10-20-18(21-11-15)23(2)3;1-13-18(4-3-9-20-13)16-6-5-15-7-8-19(11-17(15)10-16)12-22-14(2)21-19;1-13-8-16(11-20-10-13)17-5-3-4-15-9-19(7-6-18(15)17)12-22-14(2)21-19;1-14-20-19(13-21-14)11-10-18-16(12-19)8-5-9-17(18)15-6-3-2-4-7-15;1-12-22-18(10-23-12)6-5-13-3-4-14(7-15(13)8-18)16-9-20-11-21-17(16)19-2;1-13-20-18(12-21-13)8-7-14-5-6-15(10-16(14)11-18)17-4-2-3-9-19-17;1-12-19-17(11-21-12)7-5-13-3-4-14(9-15(13)10-17)16-6-8-18-20(16)2;2*1-12-20-17(10-21-12)6-5-16-13(7-17)3-2-4-15(16)14-8-18-11-19-9-14;1-11-18-16(9-19-11)6-5-13-12(7-16)3-2-4-14(13)15-8-20-10-17-15/h4-6,10-11H,7-9,12H2,1-3H3;3-6,9-10H,7-8,11-12H2,1-2H3;3-5,8,10-11H,6-7,9,12H2,1-2H3;2-9H,10-13H2,1H3;3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,19,20,21);2-6,9-10H,7-8,11-12H2,1H3;3-4,6,8-9H,5,7,10-11H2,1-2H3;2*2-4,8-9,11H,5-7,10H2,1H3;2-4,8,10H,5-7,9H2,1H3/t19-;;2*19-;18-;;;2*17-;16-/m0.001..100/s1.
What are the key properties of N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]?
N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] has a molecular weight of 2895.71 g/mol, XLogP of 32.56, 12 rotatable bonds, 1 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[(4S)-2-methylspiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyrimidin-2-amine;2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-(2-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(5-methyl-3-pyridinyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];N-methyl-5-[(4R)-2-methylspiro[5H-1,3-oxazole-4,7'-6,8-dihydro-5H-naphthalene]-2'-yl]pyrimidin-4-amine;(3S)-2'-methyl-8-phenylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridin-2-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-(1,3-thiazol-4-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] is sourced from PubChem (CID 157155466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).