tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane

C215H427N25O7S2 — CID 159746656

IUPACtert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane
SMILESCC(C)(C)C1CC1.CC(C)(C)N1CCCC1=O.CC(C)(C)n1cccc1.CC(C)(C)n1cccn1.CC(C)C(C)(C)C.CC(C)C1(N)CC1.CC(C)N1CCC(N2CCCC2)CC1.CC(C)N1CCCCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC(C)N1CCS(=O)(=O)CC1.CC(C)N1CCS(=O)CC1.CC(C)N1C[C@@H](C)O[C@@H](C)C1.CC(C)[C@H](C)C(C)(C)C.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ncc[nH]1.CCC(C)(C)C.CCCC1CCN(C(C)C)CC1.CCN1CCC(C(C)C)C1.CCN1CCC(C(C)C)CC1.CN1C2CCC1CC(C(C)(C)C)C2.COCCC(C)(C)C
InChIInChI=1S/C12H24N2.C12H23N.C11H23N.C10H22N2.C10H21N.C9H19NO.C9H19N.2C9H12.C9H20.2C8H18N2.C8H15NO.C8H13N.C8H17N.C8H11N.C7H12N2.C7H15NO2S.C7H15NOS.C7H15NO.C7H16O.C7H14.C7H16.C6H10N2.C6H13N.C6H14/c1-11(2)13-9-5-12(6-10-13)14-7-3-4-8-14;1-12(2,3)9-7-10-5-6-11(8-9)13(10)4;1-4-5-11-6-8-12(9-7-11)10(2)3;1-9(2)11-5-7-12(8-6-11)10(3)4;1-4-11-7-5-10(6-8-11)9(2)3;1-7(2)10-5-8(3)11-9(4)6-10;1-4-10-6-5-9(7-10)8(2)3;2*1-8(2)9-6-4-3-5-7-9;1-7(2)8(3)9(4,5)6;2*1-8(2)10-6-4-9(3)5-7-10;1-8(2,3)9-6-4-5-7(9)10;1-8(2,3)9-6-4-5-7-9;1-8(2)9-6-4-3-5-7-9;1-7(2)8-5-3-4-6-9-8;1-7(2,3)9-6-4-5-8-9;1-7(2)8-3-5-11(9,10)6-4-8;1-7(2)8-3-5-10(9)6-4-8;1-7(2)8-3-5-9-6-4-8;1-7(2,3)5-6-8-4;1-7(2,3)6-4-5-6;1-6(2)7(3,4)5;1-5(2)6-7-3-4-8-6;1-5(2)6(7)3-4-6;1-5-6(2,3)4/h11-12H,3-10H2,1-2H3;9-11H,5-8H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,5-8H2,1-4H3;9-10H,4-8H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;2*3-8H,1-2H3;7-8H,1-6H3;2*8H,4-7H2,1-3H3;4-6H2,1-3H3;4-7H,1-3H3;8H,3-7H2,1-2H3;3-7H,1-2H3;4-6H,1-3H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;5-6H2,1-4H3;6H,4-5H2,1-3H3;6H,1-5H3;3-5H,1-2H3,(H,7,8);5H,3-4,7H2,1-2H3;5H2,1-4H3/t;;;;;8-,9+;;;;8-;;;;;;;;;;;;;;;;/m.........0................/s1
InChIKeyNDCUCWZIQIPHDN-ZPHVPXGOSA-N
MW3539.08 g/mol
LogP48.27
Rot. Bonds26

About tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane

tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane (PubChem CID 159746656) has the molecular formula C215H427N25O7S2 and a molecular weight of 3539.08 g/mol. Its IUPAC name is tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane.

Molecular Properties

Compound Nametert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane
PubChem CID159746656
Molecular FormulaC215H427N25O7S2
Molecular Weight3539.08 g/mol
Exact Mass3536.33
IUPAC Nametert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane
SMILESCC(C)(C)C1CC1.CC(C)(C)N1CCCC1=O.CC(C)(C)n1cccc1.CC(C)(C)n1cccn1.CC(C)C(C)(C)C.CC(C)C1(N)CC1.CC(C)N1CCC(N2CCCC2)CC1.CC(C)N1CCCCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC(C)N1CCS(=O)(=O)CC1.CC(C)N1CCS(=O)CC1.CC(C)N1C[C@@H](C)O[C@@H](C)C1.CC(C)[C@H](C)C(C)(C)C.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ncc[nH]1.CCC(C)(C)C.CCCC1CCN(C(C)C)CC1.CCN1CCC(C(C)C)C1.CCN1CCC(C(C)C)CC1.CN1C2CCC1CC(C(C)(C)C)C2.COCCC(C)(C)C
InChIInChI=1S/C12H24N2.C12H23N.C11H23N.C10H22N2.C10H21N.C9H19NO.C9H19N.2C9H12.C9H20.2C8H18N2.C8H15NO.C8H13N.C8H17N.C8H11N.C7H12N2.C7H15NO2S.C7H15NOS.C7H15NO.C7H16O.C7H14.C7H16.C6H10N2.C6H13N.C6H14/c1-11(2)13-9-5-12(6-10-13)14-7-3-4-8-14;1-12(2,3)9-7-10-5-6-11(8-9)13(10)4;1-4-5-11-6-8-12(9-7-11)10(2)3;1-9(2)11-5-7-12(8-6-11)10(3)4;1-4-11-7-5-10(6-8-11)9(2)3;1-7(2)10-5-8(3)11-9(4)6-10;1-4-10-6-5-9(7-10)8(2)3;2*1-8(2)9-6-4-3-5-7-9;1-7(2)8(3)9(4,5)6;2*1-8(2)10-6-4-9(3)5-7-10;1-8(2,3)9-6-4-5-7(9)10;1-8(2,3)9-6-4-5-7-9;1-8(2)9-6-4-3-5-7-9;1-7(2)8-5-3-4-6-9-8;1-7(2,3)9-6-4-5-8-9;1-7(2)8-3-5-11(9,10)6-4-8;1-7(2)8-3-5-10(9)6-4-8;1-7(2)8-3-5-9-6-4-8;1-7(2,3)5-6-8-4;1-7(2,3)6-4-5-6;1-6(2)7(3,4)5;1-5(2)6-7-3-4-8-6;1-5(2)6(7)3-4-6;1-5-6(2,3)4/h11-12H,3-10H2,1-2H3;9-11H,5-8H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,5-8H2,1-4H3;9-10H,4-8H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;2*3-8H,1-2H3;7-8H,1-6H3;2*8H,4-7H2,1-3H3;4-6H2,1-3H3;4-7H,1-3H3;8H,3-7H2,1-2H3;3-7H,1-2H3;4-6H,1-3H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;5-6H2,1-4H3;6H,4-5H2,1-3H3;6H,1-5H3;3-5H,1-2H3,(H,7,8);5H,3-4,7H2,1-2H3;5H2,1-4H3/t;;;;;8-,9+;;;;8-;;;;;;;;;;;;;;;;/m.........0................/s1
InChIKeyNDCUCWZIQIPHDN-ZPHVPXGOSA-N
XLogP48.27
TPSA244.63 Ų
H-Bond Donors2
H-Bond Acceptors30
Rotatable Bonds26
Heavy Atoms249
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003539.08
LogP ≤ 548.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1030

Analyze tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane with MolForge

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Launch Full Analysis

Related Compounds

1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;3,4-dimethyl-1H-imidazol-3-ium;1,4-dimethylpiperidine;1,3-dimethylpyrazole;1,4-dimethylpyrazole;1,4-dimethylpyridin-2-one;ethane;4-fluoro-1,4-dimethylpiperidine;4-fluoro-4-methyloxane;4-methylcyclohexan-1-ol;2-methyl-1H-imidazole;4-methyloxane;4-methylpiperidine;1-(4-methylpiperidin-1-yl)ethanone;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;4-methylthiane 1,1-dioxide
CID 157426632
tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrolidin-2-one;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;1-methylidene-4-propan-2-yl-1,4-thiazinane;1-methylidene-4-propan-2-yl-1,4-thiazinane 1-oxide;N-methyl-1-propan-2-ylcyclopropan-1-amine;bis(1-methyl-4-propan-2-ylpiperazine);2-propan-2-yl-1H-imidazole;bis(1-propan-2-ylpiperidine);4-propan-2-yl-1-propylpiperidine;1-propan-2-ylpyrrole;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;2,2,3-trimethylbutane;(3S)-2,2,4-trimethylpentan-3-amine
CID 157649943
tert-butylbenzene;tert-butylcycloheptane;tert-butylcyclohexane;tert-butylcyclopentane;2-tert-butyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;4-tert-butylmorpholine;4-tert-butylmorpholin-3-one;3-tert-butyloxane;4-tert-butyloxane;3-tert-butyl-1,3-oxazolidin-2-one;2-tert-butyloxolane;3-tert-butyloxolane;1-tert-butylpiperazine;1-tert-butylpiperidine;3-tert-butylpiperidine;4-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridazine;4-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;2-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,2-thiazolidine 1,1-dioxide;4-tert-butylthiomorpholine;2-tert-butyl-1,3,5-triazine;3-tert-butyl-1,2,4-triazine
CID 157723017
CID 158050218
CID 158050218
1,4-dimethylimidazole;1,5-dimethylimidazole;2,5-dimethyl-1H-imidazole;1,4-dimethylpiperidine;1,3-dimethylpyrazole;1,4-dimethylpyrazole;1,4-dimethylpyridin-2-one;ethane;4-fluoro-1,4-dimethylpiperidine;4-fluoro-4-methyloxane;4-fluoro-4-methyl-1-(oxetan-3-yl)piperidine;4-fluoro-4-methylpiperidine;4-methylcyclohexan-1-ol;bis(2-methyl-1H-imidazole);4-methyloxane;4-methyl-1-(oxetan-3-yl)piperidine;4-methylpiperidine;2-(4-methylpiperidin-1-yl)ethanol;1-(4-methylpiperidin-1-yl)ethanone;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;4-methylthiane 1,1-dioxide
CID 158166887
1,4-dimethylimidazole;1,5-dimethylimidazole;2,5-dimethyl-1H-imidazole;1,4-dimethylpiperidine;1,3-dimethylpyrazole;1,4-dimethylpyrazole;1,4-dimethylpyridin-2-one;ethane;4-fluoro-1,4-dimethylpiperidine;4-fluoro-4-methyloxane;bis(4-fluoro-4-methylpiperidine);4-methylcyclohexan-1-ol;bis(2-methyl-1H-imidazole);4-methyloxane;4-methylpiperidine;2-(4-methylpiperidin-1-yl)ethanol;1-(4-methylpiperidin-1-yl)ethanone;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;4-methylthiane 1,1-dioxide
CID 158315682
2-methyl-4-propan-2-ylmorpholine;1-methyl-4-propan-2-ylpiperazine;1-methyl-5-propan-2-ylpyrazole;1-propan-2-ylazetidin-2-one;1-propan-2-ylimidazolidin-2-one;3-propan-2-yl-1H-imidazol-2-one;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperidine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyrimidin-2-amine;2-propan-2-ylpyrimidine;tris(4-propan-2-ylpyrimidine);5-propan-2-ylpyrimidine;1-propan-2-ylpyrrolidin-2-one;5-propan-2-yl-2H-tetrazole;4-propan-2-ylthiane 1,1-dioxide
CID 158360776
1,2-dimethylimidazole;1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;1,4-dimethylpiperidine;1,3-dimethylpyrazole;1,4-dimethylpyrazole;1,4-dimethylpyridin-2-one;ethane;4-fluoro-1,4-dimethylpiperidine;4-fluoro-4-methyloxane;4-fluoro-4-methyl-1-(oxetan-3-yl)piperidine;4-fluoro-4-methylpiperidine;4-methylcyclohexan-1-ol;bis(2-methyl-1H-imidazole);4-methyloxane;4-methyl-1-(oxetan-3-yl)piperidine;4-methylpiperidine;2-(4-methylpiperidin-1-yl)ethanol;1-(4-methylpiperidin-1-yl)ethanone;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;4-methylthiane 1,1-dioxide
CID 158672177
tert-butylcycloheptane;tetrakis(tert-butylcyclohexane);bis(tert-butylcyclopentane);2-tert-butyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;2-tert-butyl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine;2-tert-butyl-6-methylidene-5,7-dihydropyrrolo[2,3-d]pyrimidine;2-tert-butyl-1-methylidene-1,2-thiazolidine 1-oxide;4-tert-butylmorpholine;4-tert-butyloxane;2-tert-butyloxolane;1-tert-butylpiperazine;bis(1-tert-butylpiperidine);1-tert-butylpiperidin-2-one;2-tert-butyl-7H-purine;2-tert-butylpyrazine;3-tert-butylpyridazine;2-tert-butylpyridine;bis(3-tert-butylpyridine);bis(4-tert-butylpyridine);2-tert-butylpyrimidine;4-tert-butylpyrimidine;1-tert-butylpyrrolidine;2-tert-butylpyrrolidine;3-tert-butylpyrrolidine;1-tert-butylpyrrolidin-2-one;bis(2-tert-butyl-7H-pyrrolo[2,3-d]pyrimidine);2-tert-butyl-1,3,5-triazine;3-tert-butyl-1,2,4-triazine
CID 158849708
1,4-dimethylimidazole;1,5-dimethylimidazole;2,5-dimethyl-1H-imidazole;1,4-dimethylpiperidine;1,3-dimethylpyrazole;1,4-dimethylpyrazole;1,4-dimethylpyridin-2-one;ethane;4-fluoro-4-methyloxane;4-methylcyclohexan-1-ol;bis(2-methyl-1H-imidazole);4-methyloxane;4-methylpiperidine;1-(4-methylpiperidin-1-yl)ethanone;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;4-methylthiane 1,1-dioxide
CID 158952681
1-methyl-N-[5-[3-(7-pyridin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperidine-4-carboxamide;N-[5-[3-(7-pyridin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]cyclopropanecarboxamide;N-[5-[3-(7-pyridin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methanesulfonamide;N-[5-[3-(7-pyridin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]morpholine-4-carboxamide
CID 158974355
1-tert-butylcyclopropan-1-amine;tert-butylcyclopropane;2-tert-butyl-1H-imidazole;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-ylpyrrole;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane
CID 159132691

Frequently Asked Questions

What is the IUPAC name of tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane?
The IUPAC name of tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane (CID 159746656) is tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane.
What is the SMILES notation for tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane?
The canonical SMILES for tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane is CC(C)(C)C1CC1.CC(C)(C)N1CCCC1=O.CC(C)(C)n1cccc1.CC(C)(C)n1cccn1.CC(C)C(C)(C)C.CC(C)C1(N)CC1.CC(C)N1CCC(N2CCCC2)CC1.CC(C)N1CCCCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC(C)N1CCS(=O)(=O)CC1.CC(C)N1CCS(=O)CC1.CC(C)N1C[C@@H](C)O[C@@H](C)C1.CC(C)[C@H](C)C(C)(C)C.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ncc[nH]1.CCC(C)(C)C.CCCC1CCN(C(C)C)CC1.CCN1CCC(C(C)C)C1.CCN1CCC(C(C)C)CC1.CN1C2CCC1CC(C(C)(C)C)C2.COCCC(C)(C)C.
What is the InChIKey of tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane?
The InChIKey is NDCUCWZIQIPHDN-ZPHVPXGOSA-N. The full InChI is InChI=1S/C12H24N2.C12H23N.C11H23N.C10H22N2.C10H21N.C9H19NO.C9H19N.2C9H12.C9H20.2C8H18N2.C8H15NO.C8H13N.C8H17N.C8H11N.C7H12N2.C7H15NO2S.C7H15NOS.C7H15NO.C7H16O.C7H14.C7H16.C6H10N2.C6H13N.C6H14/c1-11(2)13-9-5-12(6-10-13)14-7-3-4-8-14;1-12(2,3)9-7-10-5-6-11(8-9)13(10)4;1-4-5-11-6-8-12(9-7-11)10(2)3;1-9(2)11-5-7-12(8-6-11)10(3)4;1-4-11-7-5-10(6-8-11)9(2)3;1-7(2)10-5-8(3)11-9(4)6-10;1-4-10-6-5-9(7-10)8(2)3;2*1-8(2)9-6-4-3-5-7-9;1-7(2)8(3)9(4,5)6;2*1-8(2)10-6-4-9(3)5-7-10;1-8(2,3)9-6-4-5-7(9)10;1-8(2,3)9-6-4-5-7-9;1-8(2)9-6-4-3-5-7-9;1-7(2)8-5-3-4-6-9-8;1-7(2,3)9-6-4-5-8-9;1-7(2)8-3-5-11(9,10)6-4-8;1-7(2)8-3-5-10(9)6-4-8;1-7(2)8-3-5-9-6-4-8;1-7(2,3)5-6-8-4;1-7(2,3)6-4-5-6;1-6(2)7(3,4)5;1-5(2)6-7-3-4-8-6;1-5(2)6(7)3-4-6;1-5-6(2,3)4/h11-12H,3-10H2,1-2H3;9-11H,5-8H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,5-8H2,1-4H3;9-10H,4-8H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;2*3-8H,1-2H3;7-8H,1-6H3;2*8H,4-7H2,1-3H3;4-6H2,1-3H3;4-7H,1-3H3;8H,3-7H2,1-2H3;3-7H,1-2H3;4-6H,1-3H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;5-6H2,1-4H3;6H,4-5H2,1-3H3;6H,1-5H3;3-5H,1-2H3,(H,7,8);5H,3-4,7H2,1-2H3;5H2,1-4H3/t;;;;;8-,9+;;;;8-;;;;;;;;;;;;;;;;/m.........0................/s1.
What are the key properties of tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane?
tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane has a molecular weight of 3539.08 g/mol, XLogP of 48.27, 26 rotatable bonds, 2 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butylcyclopropane;3-tert-butyl-8-methyl-8-azabicyclo[3.2.1]octane;1-tert-butylpyrazole;1-tert-butylpyrrole;1-tert-butylpyrrolidin-2-one;cumene;2,2-dimethylbutane;(2S,6R)-2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperidine;1-ethyl-3-propan-2-ylpyrrolidine;1-methoxy-3,3-dimethylbutane;bis(1-methyl-4-propan-2-ylpiperazine);1-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-propylpiperidine;2-propan-2-ylpyridine;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-yl-1,4-thiazinane 1-oxide;(3S)-2,2,3,4-tetramethylpentane;2,2,3-trimethylbutane is sourced from PubChem (CID 159746656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).