3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene

C240H458N18O7S4 — CID 159493591

IUPAC3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)CN1CCOCC1.CC(C)(C)Cc1cc[nH]c1.CC(C)(C)Cc1ccc[nH]1.CC(C)(C)Cc1ccoc1.CC(C)(C)Cc1ccsc1.CC(C)(C)Cc1cncs1.CC(C)CC1CC1.CC(C)CC1CCC(=O)N1.CC(C)CC1CCOC1.CC(C)CN1CCCC1.CC(C)CN1CCCCC1.CC(C)Cc1ccc2ccccc2n1.CC(C)Cc1ccccc1.CC(C)Cc1ccccn1.CC(C)Cc1cccnc1.CC(C)Cc1ccco1.CC(C)Cc1cccs1.CC(C)Cc1ccncc1.CC(C)Cc1cnc[nH]1.CC(C)Cc1cnco1.CC(C)Cc1ncc[nH]1.CC(C)Cc1ncco1.CC(C)Cc1nccs1
InChIInChI=1S/C13H15N.C10H14.C9H19NO.2C9H15N.3C9H13N.C9H19N.C9H14O.C9H14S.C8H15NO.C8H13NS.C8H17N.C8H16O.C8H12O.C8H12S.2C7H12N2.2C7H11NO.C7H11NS.C7H14.23C2H6/c1-10(2)9-12-8-7-11-5-3-4-6-13(11)14-12;1-9(2)8-10-6-4-3-5-7-10;1-9(2,3)8-10-4-6-11-7-5-10;1-9(2,3)6-8-4-5-10-7-8;1-9(2,3)7-8-5-4-6-10-8;1-8(2)7-9-3-5-10-6-4-9;1-8(2)6-9-4-3-5-10-7-9;1-8(2)7-9-5-3-4-6-10-9;1-9(2)8-10-6-4-3-5-7-10;2*1-9(2,3)6-8-4-5-10-7-8;1-6(2)5-7-3-4-8(10)9-7;1-8(2,3)4-7-5-9-6-10-7;1-8(2)7-9-5-3-4-6-9;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-6(2)3-7-4-8-5-9-7;1-6(2)5-7-8-3-4-9-7;1-6(2)3-7-4-8-5-9-7;2*1-6(2)5-7-8-3-4-9-7;1-6(2)5-7-3-4-7;23*1-2/h3-8,10H,9H2,1-2H3;3-7,9H,8H2,1-2H3;4-8H2,1-3H3;4-5,7,10H,6H2,1-3H3;4-6,10H,7H2,1-3H3;3-6,8H,7H2,1-2H3;3-5,7-8H,6H2,1-2H3;3-6,8H,7H2,1-2H3;9H,3-8H2,1-2H3;2*4-5,7H,6H2,1-3H3;6-7H,3-5H2,1-2H3,(H,9,10);5-6H,4H2,1-3H3;8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;2*3-5,7H,6H2,1-2H3;4-6H,3H2,1-2H3,(H,8,9);3-4,6H,5H2,1-2H3,(H,8,9);4-6H,3H2,1-2H3;2*3-4,6H,5H2,1-2H3;6-7H,3-5H2,1-2H3;23*1-2H3
InChIKeyLYMOQFGSAOJISJ-UHFFFAOYSA-N
MW3836.69 g/mol
LogP76.69
Rot. Bonds40

About 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene

3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene (PubChem CID 159493591) has the molecular formula C240H458N18O7S4 and a molecular weight of 3836.69 g/mol. Its IUPAC name is 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene.

Molecular Properties

Compound Name3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene
PubChem CID159493591
Molecular FormulaC240H458N18O7S4
Molecular Weight3836.69 g/mol
Exact Mass3833.49
IUPAC Name3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)CN1CCOCC1.CC(C)(C)Cc1cc[nH]c1.CC(C)(C)Cc1ccc[nH]1.CC(C)(C)Cc1ccoc1.CC(C)(C)Cc1ccsc1.CC(C)(C)Cc1cncs1.CC(C)CC1CC1.CC(C)CC1CCC(=O)N1.CC(C)CC1CCOC1.CC(C)CN1CCCC1.CC(C)CN1CCCCC1.CC(C)Cc1ccc2ccccc2n1.CC(C)Cc1ccccc1.CC(C)Cc1ccccn1.CC(C)Cc1cccnc1.CC(C)Cc1ccco1.CC(C)Cc1cccs1.CC(C)Cc1ccncc1.CC(C)Cc1cnc[nH]1.CC(C)Cc1cnco1.CC(C)Cc1ncc[nH]1.CC(C)Cc1ncco1.CC(C)Cc1nccs1
InChIInChI=1S/C13H15N.C10H14.C9H19NO.2C9H15N.3C9H13N.C9H19N.C9H14O.C9H14S.C8H15NO.C8H13NS.C8H17N.C8H16O.C8H12O.C8H12S.2C7H12N2.2C7H11NO.C7H11NS.C7H14.23C2H6/c1-10(2)9-12-8-7-11-5-3-4-6-13(11)14-12;1-9(2)8-10-6-4-3-5-7-10;1-9(2,3)8-10-4-6-11-7-5-10;1-9(2,3)6-8-4-5-10-7-8;1-9(2,3)7-8-5-4-6-10-8;1-8(2)7-9-3-5-10-6-4-9;1-8(2)6-9-4-3-5-10-7-9;1-8(2)7-9-5-3-4-6-10-9;1-9(2)8-10-6-4-3-5-7-10;2*1-9(2,3)6-8-4-5-10-7-8;1-6(2)5-7-3-4-8(10)9-7;1-8(2,3)4-7-5-9-6-10-7;1-8(2)7-9-5-3-4-6-9;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-6(2)3-7-4-8-5-9-7;1-6(2)5-7-8-3-4-9-7;1-6(2)3-7-4-8-5-9-7;2*1-6(2)5-7-8-3-4-9-7;1-6(2)5-7-3-4-7;23*1-2/h3-8,10H,9H2,1-2H3;3-7,9H,8H2,1-2H3;4-8H2,1-3H3;4-5,7,10H,6H2,1-3H3;4-6,10H,7H2,1-3H3;3-6,8H,7H2,1-2H3;3-5,7-8H,6H2,1-2H3;3-6,8H,7H2,1-2H3;9H,3-8H2,1-2H3;2*4-5,7H,6H2,1-3H3;6-7H,3-5H2,1-2H3,(H,9,10);5-6H,4H2,1-3H3;8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;2*3-5,7H,6H2,1-2H3;4-6H,3H2,1-2H3,(H,8,9);3-4,6H,5H2,1-2H3,(H,8,9);4-6H,3H2,1-2H3;2*3-4,6H,5H2,1-2H3;6-7H,3-5H2,1-2H3;23*1-2H3
InChIKeyLYMOQFGSAOJISJ-UHFFFAOYSA-N
XLogP76.69
TPSA301.90 Ų
H-Bond Donors5
H-Bond Acceptors24
Rotatable Bonds40
Heavy Atoms269
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003836.69
LogP ≤ 576.69
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1024

Analyze 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene with MolForge

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Related Compounds

CID 157497476
CID 157497476
cumene;2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;methane;2-methyl-5-propan-2-yl-1H-imidazole;pentakis(2-methyl-5-propan-2-ylpyridine);1-propan-2-ylcyclopenta-1,3-diene;2-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;bis(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);4-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;4-propan-2-ylpyrimidine;4-propan-2-yl-3H-pyrrole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-2-(trifluoromethyl)pyridine)
CID 158218996
(2'R,4'S,4'aS)-2',4'-dimethyl-8'-[4-(1,3-oxazol-2-yl)-1,3-oxazol-2-yl]spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione;(2'R,4'S,4'aS)-2',4'-dimethyl-8'-[5-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione;(2'S,4'S,4'aS)-10'-fluoro-8'-[3-(1H-imidazol-2-yl)propanoyl]-4'-methyl-2'-(trifluoromethyl)spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione;(2'R,4'S,4'aS)-8'-(6-fluoro-3-pyridinyl)-2',4'-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione;(2'R,4'S,4'aS)-8'-[5-(1H-imidazol-2-yl)-1H-imidazol-2-yl]-2',4'-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione
CID 158293483
cumene;methane;2-methyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1H-indole;5-propan-2-yl-1,2,4-oxadiazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;bis(5-propan-2-yl-1H-pyrazole);bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1,2,4-thiadiazole;bis(2-propan-2-yl-1,3-thiazole);bis(2-propan-2-ylthiophene);2-propan-2-yl-5-(trifluoromethyl)-1,3-thiazole
CID 159939351
CID 161081028
CID 161081028
1-tert-butyl-4-propan-2-ylcyclohexane;2-tert-butyl-5-propan-2-ylthiophene;1,1-difluoro-4-propan-2-ylcyclohexane;1,1-dimethyl-4-propan-2-ylcyclohexane;3,4-dimethyl-1-propan-2-ylpyrrolidine;1,4-di(propan-2-yl)cyclohexane;1-ethyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;2-phenyl-5-propan-2-ylthiophene;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylfuran;4-propan-2-yloxane;2-propan-2-yl-1,3-oxazole;2-propan-2-yloxolane;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-yl-2H-pyrrole;2-propan-2-ylpyrrolidine;3-propan-2-ylpyrrolidine;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;2,2,3-trimethylbutan-1-ol
CID 161694450
4-[5-[3-[2-[4-[3-[3-[3-(1H-imidazol-2-yl)-1H-pyrrol-2-yl]thiophen-2-yl]furan-2-yl]-1,3-thiazol-2-yl]piperazin-1-yl]oxan-2-yl]-2-piperidin-1-yl-2-(1,3-thiazolidin-2-yl)pyrrolidin-3-yl]-3-(2-quinazolin-2-yl-1,3-oxazolidin-2-yl)morpholine
CID 123776950
3-[1-[1-[2-[2-[2-[4-(3-hydroxy-2-pyridinyl)-1H-imidazol-5-yl]thiophen-3-yl]furan-3-yl]-3-pyridinyl]piperazin-2-yl]piperidin-2-yl]-4-[3-[4-(1,3-thiazol-2-yl)-1,3-oxazol-2-yl]isoquinolin-1-yl]-1H-quinolin-2-one
CID 135984016
2-[3-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-2-(1H-pyrrol-2-yl)-2-quinolin-2-yl-4-(1,3-thiazol-2-yl)-4H-pyrimidin-5-yl]-1,3-oxazole
CID 140995926
2-[3-(furan-2-yl)-2-(1H-imidazol-2-yl)-5-(1H-indol-2-yl)-6-(1H-pyrrol-2-yl)-6-(1,3-thiazol-2-yl)-4-thiophen-2-ylcyclohexa-2,4-dien-1-yl]-1,3-oxazole
CID 141008273
2-[6-(1-benzofuran-2-yl)-5-(1-benzothiophen-2-yl)-5-(1H-imidazol-2-yl)-3-(1H-indol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)cyclohexa-1,3-dien-1-yl]-1,3-oxazole
CID 141151189
2-[1-(furan-2-yl)-4-(1H-imidazol-2-yl)-3-pyridin-2-yl-6-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-6-(1,2-thiazol-3-yl)-5-(1,3-thiazol-2-yl)-2-thiophen-2-ylpiperazin-2-yl]-1,3-oxazole
CID 141284523

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene?
The IUPAC name of 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene (CID 159493591) is 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene.
What is the SMILES notation for 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene?
The canonical SMILES for 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)CN1CCOCC1.CC(C)(C)Cc1cc[nH]c1.CC(C)(C)Cc1ccc[nH]1.CC(C)(C)Cc1ccoc1.CC(C)(C)Cc1ccsc1.CC(C)(C)Cc1cncs1.CC(C)CC1CC1.CC(C)CC1CCC(=O)N1.CC(C)CC1CCOC1.CC(C)CN1CCCC1.CC(C)CN1CCCCC1.CC(C)Cc1ccc2ccccc2n1.CC(C)Cc1ccccc1.CC(C)Cc1ccccn1.CC(C)Cc1cccnc1.CC(C)Cc1ccco1.CC(C)Cc1cccs1.CC(C)Cc1ccncc1.CC(C)Cc1cnc[nH]1.CC(C)Cc1cnco1.CC(C)Cc1ncc[nH]1.CC(C)Cc1ncco1.CC(C)Cc1nccs1.
What is the InChIKey of 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene?
The InChIKey is LYMOQFGSAOJISJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N.C10H14.C9H19NO.2C9H15N.3C9H13N.C9H19N.C9H14O.C9H14S.C8H15NO.C8H13NS.C8H17N.C8H16O.C8H12O.C8H12S.2C7H12N2.2C7H11NO.C7H11NS.C7H14.23C2H6/c1-10(2)9-12-8-7-11-5-3-4-6-13(11)14-12;1-9(2)8-10-6-4-3-5-7-10;1-9(2,3)8-10-4-6-11-7-5-10;1-9(2,3)6-8-4-5-10-7-8;1-9(2,3)7-8-5-4-6-10-8;1-8(2)7-9-3-5-10-6-4-9;1-8(2)6-9-4-3-5-10-7-9;1-8(2)7-9-5-3-4-6-10-9;1-9(2)8-10-6-4-3-5-7-10;2*1-9(2,3)6-8-4-5-10-7-8;1-6(2)5-7-3-4-8(10)9-7;1-8(2,3)4-7-5-9-6-10-7;1-8(2)7-9-5-3-4-6-9;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-6(2)3-7-4-8-5-9-7;1-6(2)5-7-8-3-4-9-7;1-6(2)3-7-4-8-5-9-7;2*1-6(2)5-7-8-3-4-9-7;1-6(2)5-7-3-4-7;23*1-2/h3-8,10H,9H2,1-2H3;3-7,9H,8H2,1-2H3;4-8H2,1-3H3;4-5,7,10H,6H2,1-3H3;4-6,10H,7H2,1-3H3;3-6,8H,7H2,1-2H3;3-5,7-8H,6H2,1-2H3;3-6,8H,7H2,1-2H3;9H,3-8H2,1-2H3;2*4-5,7H,6H2,1-3H3;6-7H,3-5H2,1-2H3,(H,9,10);5-6H,4H2,1-3H3;8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;2*3-5,7H,6H2,1-2H3;4-6H,3H2,1-2H3,(H,8,9);3-4,6H,5H2,1-2H3,(H,8,9);4-6H,3H2,1-2H3;2*3-4,6H,5H2,1-2H3;6-7H,3-5H2,1-2H3;23*1-2H3.
What are the key properties of 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene?
3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene has a molecular weight of 3836.69 g/mol, XLogP of 76.69, 40 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylpropyl)furan;4-(2,2-dimethylpropyl)morpholine;2-(2,2-dimethylpropyl)-1H-pyrrole;3-(2,2-dimethylpropyl)-1H-pyrrole;5-(2,2-dimethylpropyl)-1,3-thiazole;3-(2,2-dimethylpropyl)thiophene;ethane;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)furan;2-(2-methylpropyl)-1H-imidazole;5-(2-methylpropyl)-1H-imidazole;2-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)oxolane;1-(2-methylpropyl)piperidine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;1-(2-methylpropyl)pyrrolidine;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)quinoline;2-(2-methylpropyl)-1,3-thiazole;2-(2-methylpropyl)thiophene is sourced from PubChem (CID 159493591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).