4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine

C253H520F3N47O2 — CID 159797768

IUPAC4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1(F)F.CC(C)(C)N1CC2CNCC(C1)O2.CC(C)(C)N1CCC(N)C(F)C1.CC(C)(C)N1CCC(N)C(O)C1.CC(C)(C)N1CCC(N)CC1.CC(C)(C)N1CCC2(CC1)CNC2.CC(C)(C)N1CCC2(CCCN2)CC1.CC(C)(C)N1CCC2(CCNC2)CC1.CC(C)(C)N1CCC2CCNC2C1.CC(C)(C)N1CCC2CNCC2C1.CC(C)(C)N1CCCC(N)C1.CC(C)(C)N1CCNCC1.CC(C)N1CC2CCNCC2C1.CC(C)N1CC2CCNCCC2C1.CC(C)N1CC2CNCC(C2)C1.CC(C)N1CC2CNCC2C1.CC(C)N1CC2NC2C1.CC(C)N1CCC(N)C1.CC(C)N1CCC2(CCNC2)C1.CC(C)N1CCC2(CCNCC2)C1.CC(C)N1CCC2CNCC2CC1.CC(C)N1CCCC(N)CC1.CC(C)NC1CC2CNCC2C1.CC(C)NC1CCCCC1.CC(C)NC1CCNCC1
InChIInChI=1S/2C12H24N2.6C11H22N2.C10H18F2.C10H20N2O.4C10H20N2.C10H20.C9H19FN2.C9H20N2O.C9H18N2.3C9H20N2.C9H19N.2C8H18N2.C7H14N2.C7H16N2/c1-11(2,3)14-8-5-12(6-9-14)4-7-13-10-12;1-11(2,3)14-9-6-12(7-10-14)5-4-8-13-12;1-10(2,3)13-6-4-11(5-7-13)8-12-9-11;1-11(2,3)13-7-5-9-4-6-12-10(9)8-13;1-10(2)13-8-5-11(9-13)3-6-12-7-4-11;1-11(2,3)13-5-4-9-6-12-7-10(9)8-13;1-9(2)13-5-3-10-7-12-8-11(10)4-6-13;1-9(2)13-7-10-3-5-12-6-4-11(10)8-13;1-9(2,3)8-6-4-5-7-10(8,11)12;1-10(2,3)12-6-8-4-11-5-9(7-12)13-8;1-8(2)12-6-9-3-10(7-12)5-11-4-9;1-7(2)12-10-3-8-5-11-6-9(8)4-10;1-9(2)12-6-4-10(8-12)3-5-11-7-10;1-8(2)12-6-9-3-4-11-5-10(9)7-12;1-10(2,3)9-7-5-4-6-8-9;1-9(2,3)12-5-4-8(11)7(10)6-12;1-9(2,3)11-5-4-7(10)8(12)6-11;1-7(2)11-5-8-3-10-4-9(8)6-11;1-9(2,3)11-6-4-8(10)5-7-11;1-9(2,3)11-6-4-5-8(10)7-11;1-8(2)11-6-3-4-9(10)5-7-11;1-8(2)10-9-6-4-3-5-7-9;1-8(2,3)10-6-4-9-5-7-10;1-7(2)10-8-3-5-9-6-4-8;1-5(2)9-3-6-7(4-9)8-6;1-6(2)9-4-3-7(8)5-9/h2*13H,4-10H2,1-3H3;12H,4-9H2,1-3H3;9-10,12H,4-8H2,1-3H3;10,12H,3-9H2,1-2H3;9-10,12H,4-8H2,1-3H3;2*9-12H,3-8H2,1-2H3;8H,4-7H2,1-3H3;8-9,11H,4-7H2,1-3H3;8-11H,3-7H2,1-2H3;7-12H,3-6H2,1-2H3;9,11H,3-8H2,1-2H3;8-11H,3-7H2,1-2H3;9H,4-8H2,1-3H3;7-8H,4-6,11H2,1-3H3;7-8,12H,4-6,10H2,1-3H3;7-10H,3-6H2,1-2H3;2*8H,4-7,10H2,1-3H3;8-9H,3-7,10H2,1-2H3;8-10H,3-7H2,1-2H3;9H,4-7H2,1-3H3;7-10H,3-6H2,1-2H3;5-8H,3-4H2,1-2H3;6-7H,3-5,8H2,1-2H3
InChIKeyNJJUHMOGTSCOAE-UHFFFAOYSA-N
MW4310.26 g/mol
LogP33.84
Rot. Bonds16

About 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine

4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine (PubChem CID 159797768) has the molecular formula C253H520F3N47O2 and a molecular weight of 4310.26 g/mol. Its IUPAC name is 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine
PubChem CID159797768
Molecular FormulaC253H520F3N47O2
Molecular Weight4310.26 g/mol
Exact Mass4307.20
IUPAC Name4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1(F)F.CC(C)(C)N1CC2CNCC(C1)O2.CC(C)(C)N1CCC(N)C(F)C1.CC(C)(C)N1CCC(N)C(O)C1.CC(C)(C)N1CCC(N)CC1.CC(C)(C)N1CCC2(CC1)CNC2.CC(C)(C)N1CCC2(CCCN2)CC1.CC(C)(C)N1CCC2(CCNC2)CC1.CC(C)(C)N1CCC2CCNC2C1.CC(C)(C)N1CCC2CNCC2C1.CC(C)(C)N1CCCC(N)C1.CC(C)(C)N1CCNCC1.CC(C)N1CC2CCNCC2C1.CC(C)N1CC2CCNCCC2C1.CC(C)N1CC2CNCC(C2)C1.CC(C)N1CC2CNCC2C1.CC(C)N1CC2NC2C1.CC(C)N1CCC(N)C1.CC(C)N1CCC2(CCNC2)C1.CC(C)N1CCC2(CCNCC2)C1.CC(C)N1CCC2CNCC2CC1.CC(C)N1CCCC(N)CC1.CC(C)NC1CC2CNCC2C1.CC(C)NC1CCCCC1.CC(C)NC1CCNCC1
InChIInChI=1S/2C12H24N2.6C11H22N2.C10H18F2.C10H20N2O.4C10H20N2.C10H20.C9H19FN2.C9H20N2O.C9H18N2.3C9H20N2.C9H19N.2C8H18N2.C7H14N2.C7H16N2/c1-11(2,3)14-8-5-12(6-9-14)4-7-13-10-12;1-11(2,3)14-9-6-12(7-10-14)5-4-8-13-12;1-10(2,3)13-6-4-11(5-7-13)8-12-9-11;1-11(2,3)13-7-5-9-4-6-12-10(9)8-13;1-10(2)13-8-5-11(9-13)3-6-12-7-4-11;1-11(2,3)13-5-4-9-6-12-7-10(9)8-13;1-9(2)13-5-3-10-7-12-8-11(10)4-6-13;1-9(2)13-7-10-3-5-12-6-4-11(10)8-13;1-9(2,3)8-6-4-5-7-10(8,11)12;1-10(2,3)12-6-8-4-11-5-9(7-12)13-8;1-8(2)12-6-9-3-10(7-12)5-11-4-9;1-7(2)12-10-3-8-5-11-6-9(8)4-10;1-9(2)12-6-4-10(8-12)3-5-11-7-10;1-8(2)12-6-9-3-4-11-5-10(9)7-12;1-10(2,3)9-7-5-4-6-8-9;1-9(2,3)12-5-4-8(11)7(10)6-12;1-9(2,3)11-5-4-7(10)8(12)6-11;1-7(2)11-5-8-3-10-4-9(8)6-11;1-9(2,3)11-6-4-8(10)5-7-11;1-9(2,3)11-6-4-5-8(10)7-11;1-8(2)11-6-3-4-9(10)5-7-11;1-8(2)10-9-6-4-3-5-7-9;1-8(2,3)10-6-4-9-5-7-10;1-7(2)10-8-3-5-9-6-4-8;1-5(2)9-3-6-7(4-9)8-6;1-6(2)9-4-3-7(8)5-9/h2*13H,4-10H2,1-3H3;12H,4-9H2,1-3H3;9-10,12H,4-8H2,1-3H3;10,12H,3-9H2,1-2H3;9-10,12H,4-8H2,1-3H3;2*9-12H,3-8H2,1-2H3;8H,4-7H2,1-3H3;8-9,11H,4-7H2,1-3H3;8-11H,3-7H2,1-2H3;7-12H,3-6H2,1-2H3;9,11H,3-8H2,1-2H3;8-11H,3-7H2,1-2H3;9H,4-8H2,1-3H3;7-8H,4-6,11H2,1-3H3;7-8,12H,4-6,10H2,1-3H3;7-10H,3-6H2,1-2H3;2*8H,4-7,10H2,1-3H3;8-9H,3-7,10H2,1-2H3;8-10H,3-7H2,1-2H3;9H,4-7H2,1-3H3;7-10H,3-6H2,1-2H3;5-8H,3-4H2,1-2H3;6-7H,3-5,8H2,1-2H3
InChIKeyNJJUHMOGTSCOAE-UHFFFAOYSA-N
XLogP33.84
TPSA504.13 Ų
H-Bond Donors27
H-Bond Acceptors49
Rotatable Bonds16
Heavy Atoms305
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004310.26
LogP ≤ 533.84
H-Bond Donors ≤ 527
H-Bond Acceptors ≤ 1049

Analyze 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine (CID 159797768) is 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine is CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1(F)F.CC(C)(C)N1CC2CNCC(C1)O2.CC(C)(C)N1CCC(N)C(F)C1.CC(C)(C)N1CCC(N)C(O)C1.CC(C)(C)N1CCC(N)CC1.CC(C)(C)N1CCC2(CC1)CNC2.CC(C)(C)N1CCC2(CCCN2)CC1.CC(C)(C)N1CCC2(CCNC2)CC1.CC(C)(C)N1CCC2CCNC2C1.CC(C)(C)N1CCC2CNCC2C1.CC(C)(C)N1CCCC(N)C1.CC(C)(C)N1CCNCC1.CC(C)N1CC2CCNCC2C1.CC(C)N1CC2CCNCCC2C1.CC(C)N1CC2CNCC(C2)C1.CC(C)N1CC2CNCC2C1.CC(C)N1CC2NC2C1.CC(C)N1CCC(N)C1.CC(C)N1CCC2(CCNC2)C1.CC(C)N1CCC2(CCNCC2)C1.CC(C)N1CCC2CNCC2CC1.CC(C)N1CCCC(N)CC1.CC(C)NC1CC2CNCC2C1.CC(C)NC1CCCCC1.CC(C)NC1CCNCC1.
What is the InChIKey of 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine?
The InChIKey is NJJUHMOGTSCOAE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H24N2.6C11H22N2.C10H18F2.C10H20N2O.4C10H20N2.C10H20.C9H19FN2.C9H20N2O.C9H18N2.3C9H20N2.C9H19N.2C8H18N2.C7H14N2.C7H16N2/c1-11(2,3)14-8-5-12(6-9-14)4-7-13-10-12;1-11(2,3)14-9-6-12(7-10-14)5-4-8-13-12;1-10(2,3)13-6-4-11(5-7-13)8-12-9-11;1-11(2,3)13-7-5-9-4-6-12-10(9)8-13;1-10(2)13-8-5-11(9-13)3-6-12-7-4-11;1-11(2,3)13-5-4-9-6-12-7-10(9)8-13;1-9(2)13-5-3-10-7-12-8-11(10)4-6-13;1-9(2)13-7-10-3-5-12-6-4-11(10)8-13;1-9(2,3)8-6-4-5-7-10(8,11)12;1-10(2,3)12-6-8-4-11-5-9(7-12)13-8;1-8(2)12-6-9-3-10(7-12)5-11-4-9;1-7(2)12-10-3-8-5-11-6-9(8)4-10;1-9(2)12-6-4-10(8-12)3-5-11-7-10;1-8(2)12-6-9-3-4-11-5-10(9)7-12;1-10(2,3)9-7-5-4-6-8-9;1-9(2,3)12-5-4-8(11)7(10)6-12;1-9(2,3)11-5-4-7(10)8(12)6-11;1-7(2)11-5-8-3-10-4-9(8)6-11;1-9(2,3)11-6-4-8(10)5-7-11;1-9(2,3)11-6-4-5-8(10)7-11;1-8(2)11-6-3-4-9(10)5-7-11;1-8(2)10-9-6-4-3-5-7-9;1-8(2,3)10-6-4-9-5-7-10;1-7(2)10-8-3-5-9-6-4-8;1-5(2)9-3-6-7(4-9)8-6;1-6(2)9-4-3-7(8)5-9/h2*13H,4-10H2,1-3H3;12H,4-9H2,1-3H3;9-10,12H,4-8H2,1-3H3;10,12H,3-9H2,1-2H3;9-10,12H,4-8H2,1-3H3;2*9-12H,3-8H2,1-2H3;8H,4-7H2,1-3H3;8-9,11H,4-7H2,1-3H3;8-11H,3-7H2,1-2H3;7-12H,3-6H2,1-2H3;9,11H,3-8H2,1-2H3;8-11H,3-7H2,1-2H3;9H,4-8H2,1-3H3;7-8H,4-6,11H2,1-3H3;7-8,12H,4-6,10H2,1-3H3;7-10H,3-6H2,1-2H3;2*8H,4-7,10H2,1-3H3;8-9H,3-7,10H2,1-2H3;8-10H,3-7H2,1-2H3;9H,4-7H2,1-3H3;7-10H,3-6H2,1-2H3;5-8H,3-4H2,1-2H3;6-7H,3-5,8H2,1-2H3.
What are the key properties of 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine?
4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 4310.26 g/mol, XLogP of 33.84, 16 rotatable bonds, 27 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-tert-butylpiperidin-3-ol;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;7-tert-butyl-2,7-diazaspiro[3.5]nonane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-fluoropiperidin-4-amine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperazine;1-tert-butylpiperidin-3-amine;1-tert-butylpiperidin-4-amine;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;1-propan-2-ylazepan-4-amine;N-propan-2-ylcyclohexanamine;3-propan-2-yl-3,6-diazabicyclo[3.1.0]hexane;3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane;2-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine;1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 159797768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).