2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine

C187H378F2N28O — CID 159438062

IUPAC2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine
SMILESC.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1(F)F.CC(C)(C)N1CC2CNCC(C1)O2.CC(C)(C)N1CCC(N)CC1.CC(C)(C)N1CCC2(CCCN2)CC1.CC(C)(C)N1CCC2(CCNC2)CC1.CC(C)(C)N1CCC2CCCC2C1.CC(C)(C)N1CCC2CCNC2C1.CC(C)N1CC2CCNCC2C1.CC(C)N1CC2CCNCCC2C1.CC(C)N1CC2CNCC2C1.CC(C)N1CCC2(CCCCC2)C1.CC(C)N1CCC2(CCNC2)C1.CC(C)N1CCC2CNCC2CC1.CC(C)NC1CC2CNCC2C1.CC(C)NC1CCCCC1.CC(C)NC1CCNCC1.CC1CCCN(C(C)(C)C)C1
InChIInChI=1S/2C12H24N2.2C12H23N.3C11H22N2.C10H18F2.C10H20N2O.3C10H20N2.C10H21N.C10H20.C9H18N2.C9H20N2.C9H19N.C8H18N2.CH4/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;1-12(2,3)13-8-7-10-5-4-6-11(10)9-13;1-11(2)13-9-8-12(10-13)6-4-3-5-7-12;1-11(2,3)13-7-5-9-4-6-12-10(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;1-7(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;1-9-6-5-7-11(8-9)10(2,3)4;1-10(2,3)9-7-5-4-6-8-9;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;1-8(2)10-9-6-4-3-5-7-9;1-7(2)10-8-3-5-9-6-4-8;/h2*13H,4-10H2,1-3H3;10-11H,4-9H2,1-3H3;11H,3-10H2,1-2H3;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;7-12H,3-6H2,1-2H3;9,11H,3-8H2,1-2H3;8-11H,3-7H2,1-2H3;9H,5-8H2,1-4H3;9H,4-8H2,1-3H3;7-10H,3-6H2,1-2H3;8H,4-7,10H2,1-3H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;1H4
InChIKeyLRVCEMARJOUILX-UHFFFAOYSA-N
MW3073.27 g/mol
LogP32.83
Rot. Bonds12

About 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine

2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine (PubChem CID 159438062) has the molecular formula C187H378F2N28O and a molecular weight of 3073.27 g/mol. Its IUPAC name is 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound Name2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine
PubChem CID159438062
Molecular FormulaC187H378F2N28O
Molecular Weight3073.27 g/mol
Exact Mass3071.04
IUPAC Name2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine
SMILESC.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1(F)F.CC(C)(C)N1CC2CNCC(C1)O2.CC(C)(C)N1CCC(N)CC1.CC(C)(C)N1CCC2(CCCN2)CC1.CC(C)(C)N1CCC2(CCNC2)CC1.CC(C)(C)N1CCC2CCCC2C1.CC(C)(C)N1CCC2CCNC2C1.CC(C)N1CC2CCNCC2C1.CC(C)N1CC2CCNCCC2C1.CC(C)N1CC2CNCC2C1.CC(C)N1CCC2(CCCCC2)C1.CC(C)N1CCC2(CCNC2)C1.CC(C)N1CCC2CNCC2CC1.CC(C)NC1CC2CNCC2C1.CC(C)NC1CCCCC1.CC(C)NC1CCNCC1.CC1CCCN(C(C)(C)C)C1
InChIInChI=1S/2C12H24N2.2C12H23N.3C11H22N2.C10H18F2.C10H20N2O.3C10H20N2.C10H21N.C10H20.C9H18N2.C9H20N2.C9H19N.C8H18N2.CH4/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;1-12(2,3)13-8-7-10-5-4-6-11(10)9-13;1-11(2)13-9-8-12(10-13)6-4-3-5-7-12;1-11(2,3)13-7-5-9-4-6-12-10(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;1-7(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;1-9-6-5-7-11(8-9)10(2,3)4;1-10(2,3)9-7-5-4-6-8-9;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;1-8(2)10-9-6-4-3-5-7-9;1-7(2)10-8-3-5-9-6-4-8;/h2*13H,4-10H2,1-3H3;10-11H,4-9H2,1-3H3;11H,3-10H2,1-2H3;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;7-12H,3-6H2,1-2H3;9,11H,3-8H2,1-2H3;8-11H,3-7H2,1-2H3;9H,5-8H2,1-4H3;9H,4-8H2,1-3H3;7-10H,3-6H2,1-2H3;8H,4-7,10H2,1-3H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;1H4
InChIKeyLRVCEMARJOUILX-UHFFFAOYSA-N
XLogP32.83
TPSA245.79 Ų
H-Bond Donors15
H-Bond Acceptors29
Rotatable Bonds12
Heavy Atoms218
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003073.27
LogP ≤ 532.83
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1029

Analyze 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

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
6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;1-propan-2-yl-1-azaspiro[4.4]nonane;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;7-propan-2-yl-1,7-diazaspiro[4.4]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane
CID 161486035
bis(1-tert-butyl-3-methylazetidine);(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;4-tert-butyl-1-propan-2-ylpiperidine;1,4-ditert-butylpiperidine;ethane
CID 167673709
2-tert-butyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;7-tert-butyl-2,3,3a,4,5,6,8,8a-octahydro-1H-pyrrolo[2,3-c]azepine;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-tert-butyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;2-tert-butyl-1,3,4,5,5a,6,7,8-octahydropyrrolo[1,2-c][1,3]diazepine;2-tert-butyl-2-azaspiro[4.4]nonane;2-tert-butyl-2-azaspiro[5.5]undecane;9-tert-butyl-3,9-diazabicyclo[3.3.1]nonane;3-tert-butyl-3,6-diazabicyclo[3.2.1]octane;2-tert-butyl-2,8-diazaspiro[4.5]decane;1-tert-butyl-3,5-dimethanidylpiperidine;3-tert-butyl-8-oxa-3,10-diazabicyclo[4.3.1]decane;1'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine];tungsten(2+)
CID 159947320
5-tert-butyl-2-[(1-tert-butylpiperidin-4-yl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2-tert-butyl-8-propan-2-yl-2,8-diazaspiro[4.5]decane
CID 167617800
2-tert-butyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;7-tert-butyl-2,3,3a,4,5,6,8,8a-octahydro-1H-pyrrolo[2,3-c]azepine;5-tert-butyl-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-tert-butyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;2-tert-butyl-1,3,4,5,5a,6,7,8-octahydropyrrolo[1,2-c][1,3]diazepine;4-tert-butyl-1,4-diazabicyclo[3.2.2]nonane;9-tert-butyl-3,9-diazabicyclo[3.3.1]nonane;3-tert-butyl-3,6-diazabicyclo[3.2.1]octane;2-tert-butyl-2,9-diazaspiro[5.5]undecane;3-tert-butyl-8-oxa-3,10-diazabicyclo[4.3.1]decane;methane
CID 161432244
9-[2-(7-propan-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)propan-2-yl]-1,9-diazaspiro[5.5]undecane
CID 146177298
2-propan-2-yl-2,7-diazaspiro[4.4]nonane
CID 58821247
N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide
CID 163997746
4-[2-(1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-6-yl)-2-methylpropyl]-8-tert-butyl-2,8-diazaspiro[4.5]decane
CID 170139657
6-tert-butyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline;5-tert-butyl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole;6-tert-butyl-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[c]pyridine;5-tert-butyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;7-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline;2-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 158694990
1-tert-butylazetidine;1-tert-butyl-3-fluoro-3-methylazetidine;1-tert-butyl-4-fluoro-4-methylpiperidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;1-tert-butyl-3-methylazetidine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butyl-3-methylpyrrolidine);(3S)-1-tert-butyl-3-methylpyrrolidine;tris(1-tert-butylpiperidine);1-tert-butylpyrrolidine;1-ethylpiperazin-2-one;3-fluoro-3-methylpiperidine;2-methylidenepiperazine;1-methyl-2-methylidenepiperazine;3-methylpiperidine;pentakis(2-methylpropane);3-methyl-1-propan-2-ylpiperidine
CID 158169365

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine?
The IUPAC name of 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine (CID 159438062) is 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine?
The canonical SMILES for 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine is C.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1(F)F.CC(C)(C)N1CC2CNCC(C1)O2.CC(C)(C)N1CCC(N)CC1.CC(C)(C)N1CCC2(CCCN2)CC1.CC(C)(C)N1CCC2(CCNC2)CC1.CC(C)(C)N1CCC2CCCC2C1.CC(C)(C)N1CCC2CCNC2C1.CC(C)N1CC2CCNCC2C1.CC(C)N1CC2CCNCCC2C1.CC(C)N1CC2CNCC2C1.CC(C)N1CCC2(CCCCC2)C1.CC(C)N1CCC2(CCNC2)C1.CC(C)N1CCC2CNCC2CC1.CC(C)NC1CC2CNCC2C1.CC(C)NC1CCCCC1.CC(C)NC1CCNCC1.CC1CCCN(C(C)(C)C)C1.
What is the InChIKey of 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine?
The InChIKey is LRVCEMARJOUILX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H24N2.2C12H23N.3C11H22N2.C10H18F2.C10H20N2O.3C10H20N2.C10H21N.C10H20.C9H18N2.C9H20N2.C9H19N.C8H18N2.CH4/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;1-12(2,3)13-8-7-10-5-4-6-11(10)9-13;1-11(2)13-9-8-12(10-13)6-4-3-5-7-12;1-11(2,3)13-7-5-9-4-6-12-10(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;1-7(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;1-9-6-5-7-11(8-9)10(2,3)4;1-10(2,3)9-7-5-4-6-8-9;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;1-8(2)10-9-6-4-3-5-7-9;1-7(2)10-8-3-5-9-6-4-8;/h2*13H,4-10H2,1-3H3;10-11H,4-9H2,1-3H3;11H,3-10H2,1-2H3;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;7-12H,3-6H2,1-2H3;9,11H,3-8H2,1-2H3;8-11H,3-7H2,1-2H3;9H,5-8H2,1-4H3;9H,4-8H2,1-3H3;7-10H,3-6H2,1-2H3;8H,4-7,10H2,1-3H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;1H4.
What are the key properties of 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine?
2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine has a molecular weight of 3073.27 g/mol, XLogP of 32.83, 12 rotatable bonds, 15 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[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;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;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;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 159438062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).