tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate

C194H252N22O45 — CID 167553620

IUPACtert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1C2CCC1CC(c1ccc3[nH]c(=O)oc3c1)C2.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1(C)C.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1=O.CC(C)(C)OC(=O)N1CCC(c2ccc3oc(=O)[nH]c3c2)CC1.CC(C)(C)OC(=O)N1CCC(c2cccc3[nH]c(=O)oc23)CC1.CC(C)(C)OC(=O)N1CCC(c2cccc3oc(=O)[nH]c23)CC1.CC(C)(C)OC(=O)N1CCCC(c2ccc3[nH]c(=O)oc3c2)C1.CC1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C.C[C@@H]1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C.C[C@H]1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C
InChIInChI=1S/C19H24N2O4.C19H26N2O4.3C18H24N2O4.C17H20N2O5.5C17H22N2O4/c1-19(2,3)25-18(23)21-13-5-6-14(21)9-12(8-13)11-4-7-15-16(10-11)24-17(22)20-15;1-18(2,3)25-17(23)21-9-8-13(11-19(21,4)5)12-6-7-14-15(10-12)24-16(22)20-14;3*1-11-9-13(7-8-20(11)17(22)24-18(2,3)4)12-5-6-14-15(10-12)23-16(21)19-14;1-17(2,3)24-16(22)19-7-6-11(9-14(19)20)10-4-5-12-13(8-10)23-15(21)18-12;1-17(2,3)23-16(21)19-8-6-11(7-9-19)12-4-5-14-13(10-12)18-15(20)22-14;1-17(2,3)23-16(21)19-8-6-11(7-9-19)12-4-5-13-14(10-12)22-15(20)18-13;1-17(2,3)23-16(21)19-8-4-5-12(10-19)11-6-7-13-14(9-11)22-15(20)18-13;1-17(2,3)23-16(21)19-9-7-11(8-10-19)12-5-4-6-13-14(12)18-15(20)22-13;1-17(2,3)23-16(21)19-9-7-11(8-10-19)12-5-4-6-13-14(12)22-15(20)18-13/h4,7,10,12-14H,5-6,8-9H2,1-3H3,(H,20,22);6-7,10,13H,8-9,11H2,1-5H3,(H,20,22);3*5-6,10-11,13H,7-9H2,1-4H3,(H,19,21);4-5,8,11H,6-7,9H2,1-3H3,(H,18,21);2*4-5,10-11H,6-9H2,1-3H3,(H,18,20);6-7,9,12H,4-5,8,10H2,1-3H3,(H,18,20);2*4-6,11H,7-10H2,1-3H3,(H,18,20)/t;;2*11-,13?;;;;;;;/m..10......./s1
InChIKeyCSMJLLMPTZWNGO-PJHGZJOWSA-N
MW3612.26 g/mol
LogP37.59
Rot. Bonds11

About tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate

tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate (PubChem CID 167553620) has the molecular formula C194H252N22O45 and a molecular weight of 3612.26 g/mol. Its IUPAC name is tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate
PubChem CID167553620
Molecular FormulaC194H252N22O45
Molecular Weight3612.26 g/mol
Exact Mass3609.81
IUPAC Nametert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1C2CCC1CC(c1ccc3[nH]c(=O)oc3c1)C2.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1(C)C.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1=O.CC(C)(C)OC(=O)N1CCC(c2ccc3oc(=O)[nH]c3c2)CC1.CC(C)(C)OC(=O)N1CCC(c2cccc3[nH]c(=O)oc23)CC1.CC(C)(C)OC(=O)N1CCC(c2cccc3oc(=O)[nH]c23)CC1.CC(C)(C)OC(=O)N1CCCC(c2ccc3[nH]c(=O)oc3c2)C1.CC1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C.C[C@@H]1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C.C[C@H]1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C
InChIInChI=1S/C19H24N2O4.C19H26N2O4.3C18H24N2O4.C17H20N2O5.5C17H22N2O4/c1-19(2,3)25-18(23)21-13-5-6-14(21)9-12(8-13)11-4-7-15-16(10-11)24-17(22)20-15;1-18(2,3)25-17(23)21-9-8-13(11-19(21,4)5)12-6-7-14-15(10-12)24-16(22)20-14;3*1-11-9-13(7-8-20(11)17(22)24-18(2,3)4)12-5-6-14-15(10-12)23-16(21)19-14;1-17(2,3)24-16(22)19-7-6-11(9-14(19)20)10-4-5-12-13(8-10)23-15(21)18-12;1-17(2,3)23-16(21)19-8-6-11(7-9-19)12-4-5-14-13(10-12)18-15(20)22-14;1-17(2,3)23-16(21)19-8-6-11(7-9-19)12-4-5-13-14(10-12)22-15(20)18-13;1-17(2,3)23-16(21)19-8-4-5-12(10-19)11-6-7-13-14(9-11)22-15(20)18-13;1-17(2,3)23-16(21)19-9-7-11(8-10-19)12-5-4-6-13-14(12)18-15(20)22-13;1-17(2,3)23-16(21)19-9-7-11(8-10-19)12-5-4-6-13-14(12)22-15(20)18-13/h4,7,10,12-14H,5-6,8-9H2,1-3H3,(H,20,22);6-7,10,13H,8-9,11H2,1-5H3,(H,20,22);3*5-6,10-11,13H,7-9H2,1-4H3,(H,19,21);4-5,8,11H,6-7,9H2,1-3H3,(H,18,21);2*4-5,10-11H,6-9H2,1-3H3,(H,18,20);6-7,9,12H,4-5,8,10H2,1-3H3,(H,18,20);2*4-6,11H,7-10H2,1-3H3,(H,18,20)/t;;2*11-,13?;;;;;;;/m..10......./s1
InChIKeyCSMJLLMPTZWNGO-PJHGZJOWSA-N
XLogP37.59
TPSA848.01 Ų
H-Bond Donors11
H-Bond Acceptors45
Rotatable Bonds11
Heavy Atoms261
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003612.26
LogP ≤ 537.59
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1045

Analyze tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate with MolForge

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Launch Full Analysis

Related Compounds

bis(4-tert-butyl-3H-1,3-benzoxazol-2-one);6-tert-butyl-3H-1,3-benzoxazol-2-one;7-tert-butyl-3H-1,3-benzoxazol-2-one;8-tert-butyl-3,4-dihydro-2H-1,4-benzoxazine;6-tert-butyl-4-methyl-1,4-benzoxazin-3-one;7-tert-butyl-4-methyl-1,4-benzoxazin-3-one;8-tert-butyl-4-methyl-1,4-benzoxazin-3-one;4-tert-butyl-3-methyl-1,3-benzoxazol-2-one;7-tert-butyl-3-methyl-1,3-benzoxazol-2-one
CID 157583841
7-tert-butyl-3H-1,3-benzoxazol-2-one;8-tert-butyl-3,4-dihydro-2H-1,4-benzoxazine;8-tert-butyl-4-methyl-1,4-benzoxazin-3-one;7-tert-butyl-3-methyl-1,3-benzoxazol-2-one;6-tert-butyl-1-methyl-3,4-dihydroquinolin-2-one;7-tert-butyl-1-methyl-3,4-dihydroquinolin-2-one;4-tert-butyl-2-methylidene-3H-1,3-benzoxazole;5-tert-butyl-2-methylidene-3H-1,3-benzoxazole;6-tert-butyl-2-methylidene-3H-1,3-benzoxazole;4-tert-butyl-3-methyl-2-methylidene-1,3-benzoxazole
CID 161390909
4-methyl-5-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-6-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;2-methyl-4-propan-2-yl-2,3-dihydro-1,3-benzoxazole;2-methyl-5-propan-2-yl-2,3-dihydro-1,3-benzoxazole;2-methyl-6-propan-2-yl-2,3-dihydro-1,3-benzoxazole;2-methyl-7-propan-2-yl-2,3-dihydro-1,3-benzoxazole;5-propan-2-yl-3,4-dihydro-2H-1,4-benzoxazine;6-propan-2-yl-3,4-dihydro-2H-1,4-benzoxazine;7-propan-2-yl-3,4-dihydro-2H-1,4-benzoxazine;8-propan-2-yl-3,4-dihydro-2H-1,4-benzoxazine;4-propan-2-yl-2,3-dihydro-1,3-benzoxazole;5-propan-2-yl-2,3-dihydro-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1,3-benzoxazole;7-propan-2-yl-2,3-dihydro-1,3-benzoxazole
CID 161667609
6-(8-azabicyclo[3.2.1]octan-3-yl)-3-methyl-1,3-benzoxazol-2-one;6-cyclohexyl-3-methyl-1,3-benzoxazol-2-one;3-[2-(dimethylamino)ethyl]-6-(2,2-dimethylpiperidin-4-yl)-1,3-benzoxazol-2-one;6-(2,2-dimethylpiperidin-4-yl)-3-methyl-1,3-benzoxazol-2-one;3-methyl-6-[(2R)-2-methylpiperidin-4-yl]-1,3-benzoxazol-2-one;3-methyl-6-[(2S)-2-methylpiperidin-4-yl]-1,3-benzoxazol-2-one;3-methyl-6-(2-methylpiperidin-4-yl)-1,3-benzoxazol-2-one;3-methyl-6-(2-oxa-5-azaspiro[3.5]nonan-8-yl)-1,3-benzoxazol-2-one;3-methyl-6-(2-oxopiperidin-4-yl)-1,3-benzoxazol-2-one;3-methyl-4-piperidin-4-yl-1,3-benzoxazol-2-one;3-methyl-5-piperidin-4-yl-1,3-benzoxazol-2-one;3-methyl-6-piperidin-4-yl-1,3-benzoxazol-2-one;3-methyl-7-piperidin-4-yl-1,3-benzoxazol-2-one;3-(1-methylpiperidin-4-yl)-6-piperidin-4-yl-1,3-benzoxazol-2-one
CID 167535939
CID 167553872
CID 167553872
6-cyclohexyl-3-methyl-1,3-benzoxazol-2-one;6-(2,2-dimethylpiperidin-4-yl)-3-methyl-1,3-benzoxazol-2-one;3-methyl-6-[(2R)-2-methylpiperidin-4-yl]-1,3-benzoxazol-2-one;3-methyl-6-[(2S)-2-methylpiperidin-4-yl]-1,3-benzoxazol-2-one;3-methyl-6-(2-methylpiperidin-4-yl)-1,3-benzoxazol-2-one;3-methyl-4-piperidin-4-yl-1,3-benzoxazol-2-one
CID 167564020
Benzyl 3,3-dimethyl-5-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)piperazine-1-carboxylate;benzyl 3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)piperazine-1-carboxylate;6-(5,5-dimethylmorpholin-3-yl)-3-methyl-1,3-benzoxazol-2-one;3-methyl-6-morpholin-3-yl-1,3-benzoxazol-2-one;3-methyl-6-piperidin-2-yl-1,3-benzoxazol-2-one;3-methyl-6-pyrrolidin-2-yl-1,3-benzoxazol-2-one
CID 167565384
6-(8-Azabicyclo[3.2.1]octan-3-yl)-3-methyl-1,3-benzoxazol-2-one;6-(5-azaspiro[3.5]nonan-8-yl)-3-methyl-1,3-benzoxazol-2-one;3-[2-(dimethylamino)ethyl]-6-(2,2-dimethylpiperidin-4-yl)-1,3-benzoxazol-2-one;3-methyl-6-(2-oxopiperidin-4-yl)-1,3-benzoxazol-2-one
CID 167572338
6-cyclohexyl-3H-1,3-benzoxazol-2-one;6-(2,2-dimethylpiperidin-4-yl)-3H-1,3-benzoxazol-2-one;3-methyl-5-piperidin-4-yl-1,3-benzoxazol-2-one;3-methyl-6-piperidin-4-yl-1,3-benzoxazol-2-one;3-methyl-7-piperidin-4-yl-1,3-benzoxazol-2-one;3-(1-methylpiperidin-4-yl)-6-piperidin-4-yl-1,3-benzoxazol-2-one;6-piperidin-4-yl-3H-1,3-benzoxazol-2-one
CID 167583770
7-tert-butyl-3H-1,3-benzoxazol-2-one;8-tert-butyl-3,4-dihydro-2H-1,4-benzoxazine;6-tert-butyl-4-methyl-1,4-benzoxazin-3-one;7-tert-butyl-4-methyl-1,4-benzoxazin-3-one;8-tert-butyl-4-methyl-1,4-benzoxazin-3-one;7-tert-butyl-3-methyl-1,3-benzoxazol-2-one;4-tert-butyl-2-methylidene-3H-1,3-benzoxazole;5-tert-butyl-2-methylidene-3H-1,3-benzoxazole;6-tert-butyl-2-methylidene-3H-1,3-benzoxazole;4-tert-butyl-3-methyl-2-methylidene-1,3-benzoxazole
CID 167589744
1-(6-methylidene-2-oxopiperidin-3-yl)-3-propan-2-ylbenzimidazol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-6-propan-2-yl-1,3-benzoxazol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-7-propan-2-yl-1,3-benzoxazol-2-one;1-methyl-3-(6-methylidene-2-oxopiperidin-3-yl)-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3S)-6-methylidene-2-oxopiperidin-3-yl]-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3R)-6-methylidene-2-oxopiperidin-3-yl]-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3S)-6-methylidene-2-oxopiperidin-3-yl]-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3R)-6-methylidene-2-oxopiperidin-3-yl]-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-(6-methylidene-2-oxopiperidin-3-yl)-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-(6-methylidene-2-oxopiperidin-3-yl)-5-propan-2-ylbenzimidazol-2-one
CID 167600021
benzyl 3,3-dimethyl-5-(2-oxo-3H-1,3-benzoxazol-6-yl)piperazine-1-carboxylate;benzyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperazine-1-carboxylate;6-(5,5-dimethylmorpholin-3-yl)-3H-1,3-benzoxazol-2-one;6-morpholin-3-yl-3H-1,3-benzoxazol-2-one;6-piperidin-2-yl-3H-1,3-benzoxazol-2-one
CID 167669193

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate?
The IUPAC name of tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate (CID 167553620) is tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate?
The canonical SMILES for tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate is CC(C)(C)OC(=O)N1C2CCC1CC(c1ccc3[nH]c(=O)oc3c1)C2.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1(C)C.CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]c(=O)oc3c2)CC1=O.CC(C)(C)OC(=O)N1CCC(c2ccc3oc(=O)[nH]c3c2)CC1.CC(C)(C)OC(=O)N1CCC(c2cccc3[nH]c(=O)oc23)CC1.CC(C)(C)OC(=O)N1CCC(c2cccc3oc(=O)[nH]c23)CC1.CC(C)(C)OC(=O)N1CCCC(c2ccc3[nH]c(=O)oc3c2)C1.CC1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C.C[C@@H]1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C.C[C@H]1CC(c2ccc3[nH]c(=O)oc3c2)CCN1C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate?
The InChIKey is CSMJLLMPTZWNGO-PJHGZJOWSA-N. The full InChI is InChI=1S/C19H24N2O4.C19H26N2O4.3C18H24N2O4.C17H20N2O5.5C17H22N2O4/c1-19(2,3)25-18(23)21-13-5-6-14(21)9-12(8-13)11-4-7-15-16(10-11)24-17(22)20-15;1-18(2,3)25-17(23)21-9-8-13(11-19(21,4)5)12-6-7-14-15(10-12)24-16(22)20-14;3*1-11-9-13(7-8-20(11)17(22)24-18(2,3)4)12-5-6-14-15(10-12)23-16(21)19-14;1-17(2,3)24-16(22)19-7-6-11(9-14(19)20)10-4-5-12-13(8-10)23-15(21)18-12;1-17(2,3)23-16(21)19-8-6-11(7-9-19)12-4-5-14-13(10-12)18-15(20)22-14;1-17(2,3)23-16(21)19-8-6-11(7-9-19)12-4-5-13-14(10-12)22-15(20)18-13;1-17(2,3)23-16(21)19-8-4-5-12(10-19)11-6-7-13-14(9-11)22-15(20)18-13;1-17(2,3)23-16(21)19-9-7-11(8-10-19)12-5-4-6-13-14(12)18-15(20)22-13;1-17(2,3)23-16(21)19-9-7-11(8-10-19)12-5-4-6-13-14(12)22-15(20)18-13/h4,7,10,12-14H,5-6,8-9H2,1-3H3,(H,20,22);6-7,10,13H,8-9,11H2,1-5H3,(H,20,22);3*5-6,10-11,13H,7-9H2,1-4H3,(H,19,21);4-5,8,11H,6-7,9H2,1-3H3,(H,18,21);2*4-5,10-11H,6-9H2,1-3H3,(H,18,20);6-7,9,12H,4-5,8,10H2,1-3H3,(H,18,20);2*4-6,11H,7-10H2,1-3H3,(H,18,20)/t;;2*11-,13?;;;;;;;/m..10......./s1.
What are the key properties of tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate?
tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate has a molecular weight of 3612.26 g/mol, XLogP of 37.59, 11 rotatable bonds, 11 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2,2-dimethyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2R)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl (2S)-2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 2-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-4-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate;tert-butyl 4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidine-1-carboxylate;tert-butyl 2-oxo-4-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-1-carboxylate is sourced from PubChem (CID 167553620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).