5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine

C197H396F2N32O3 — CID 159755642

IUPAC5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine
SMILESCC(C)(C)CCCNC(C)(C)C.CC(C)(C)CNC(C)(C)C.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCNCC1.CC(C)(C)N1CCOC1=O.CC(C)(C)N1CCOCC1.CC(C)(C)NCC1CC1.CC(C)(C)NCc1cccnc1.CC(C)(C)c1ccc(F)cc1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnc1.CC(C)(C)c1ncccn1.CC(C)(C)n1cccn1.CC(C)(C)n1ccnc1.CC(C)NC(C)(C)C.CC(F)CNC(C)(C)C.CCCNC(C)(C)C.CN(C)C(C)(C)C.CN(C)CCCNC(C)(C)C.CN1CCC(NC(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.CNC(C)(C)C.Cc1ncc(C(C)(C)C)n1C
InChIInChI=1S/C11H25N.C10H13F.C10H22N2.C10H16N2.C9H20N2.C9H16N2.C9H22N2.C9H13N.C9H19N.C9H13N.C9H21N.C8H18N2.C8H12N2.C8H17NO.2C8H17N.C7H16FN.2C7H12N2.C7H13NO2.2C7H17N.C6H15N.C5H13N/c1-10(2,3)8-7-9-12-11(4,5)6;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)11-9-5-7-12(4)8-6-9;1-10(2,3)12-8-9-5-4-6-11-7-9;1-9(2,3)11-7-5-10(4)6-8-11;1-7-10-6-8(11(7)5)9(2,3)4;1-9(2,3)10-7-6-8-11(4)5;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-10-9(4,5)6;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-9-5-4-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9-6-7-4-5-7;1-8(2,3)9-6-4-5-7-9;1-6(8)5-9-7(2,3)4;1-7(2,3)9-5-4-8-6-9;1-7(2,3)9-6-4-5-8-9;1-7(2,3)8-4-5-10-6(8)9;1-6(2)8-7(3,4)5;1-5-6-8-7(2,3)4;1-6(2,3)7(4)5;1-5(2,3)6-4/h12H,7-9H2,1-6H3;4-7H,1-3H3;9,11H,5-8H2,1-4H3;4-7,12H,8H2,1-3H3;5-8H2,1-4H3;6H,1-5H3;10H,6-8H2,1-5H3;4-7H,1-3H3;4-8H2,1-3H3;4-7H,1-3H3;10H,7H2,1-6H3;9H,4-7H2,1-3H3;4-6H,1-3H3;4-7H2,1-3H3;7,9H,4-6H2,1-3H3;4-7H2,1-3H3;6,9H,5H2,1-4H3;2*4-6H,1-3H3;4-5H2,1-3H3;6,8H,1-5H3;8H,5-6H2,1-4H3;1-5H3;6H,1-4H3
InChIKeyNEFKKFFRIXGIBB-UHFFFAOYSA-N
MW3299.55 g/mol
LogP43.01
Rot. Bonds18

About 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine

5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine (PubChem CID 159755642) has the molecular formula C197H396F2N32O3 and a molecular weight of 3299.55 g/mol. Its IUPAC name is 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine.

Molecular Properties

Compound Name5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine
PubChem CID159755642
Molecular FormulaC197H396F2N32O3
Molecular Weight3299.55 g/mol
Exact Mass3297.18
IUPAC Name5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine
SMILESCC(C)(C)CCCNC(C)(C)C.CC(C)(C)CNC(C)(C)C.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCNCC1.CC(C)(C)N1CCOC1=O.CC(C)(C)N1CCOCC1.CC(C)(C)NCC1CC1.CC(C)(C)NCc1cccnc1.CC(C)(C)c1ccc(F)cc1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnc1.CC(C)(C)c1ncccn1.CC(C)(C)n1cccn1.CC(C)(C)n1ccnc1.CC(C)NC(C)(C)C.CC(F)CNC(C)(C)C.CCCNC(C)(C)C.CN(C)C(C)(C)C.CN(C)CCCNC(C)(C)C.CN1CCC(NC(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.CNC(C)(C)C.Cc1ncc(C(C)(C)C)n1C
InChIInChI=1S/C11H25N.C10H13F.C10H22N2.C10H16N2.C9H20N2.C9H16N2.C9H22N2.C9H13N.C9H19N.C9H13N.C9H21N.C8H18N2.C8H12N2.C8H17NO.2C8H17N.C7H16FN.2C7H12N2.C7H13NO2.2C7H17N.C6H15N.C5H13N/c1-10(2,3)8-7-9-12-11(4,5)6;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)11-9-5-7-12(4)8-6-9;1-10(2,3)12-8-9-5-4-6-11-7-9;1-9(2,3)11-7-5-10(4)6-8-11;1-7-10-6-8(11(7)5)9(2,3)4;1-9(2,3)10-7-6-8-11(4)5;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-10-9(4,5)6;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-9-5-4-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9-6-7-4-5-7;1-8(2,3)9-6-4-5-7-9;1-6(8)5-9-7(2,3)4;1-7(2,3)9-5-4-8-6-9;1-7(2,3)9-6-4-5-8-9;1-7(2,3)8-4-5-10-6(8)9;1-6(2)8-7(3,4)5;1-5-6-8-7(2,3)4;1-6(2,3)7(4)5;1-5(2,3)6-4/h12H,7-9H2,1-6H3;4-7H,1-3H3;9,11H,5-8H2,1-4H3;4-7,12H,8H2,1-3H3;5-8H2,1-4H3;6H,1-5H3;10H,6-8H2,1-5H3;4-7H,1-3H3;4-8H2,1-3H3;4-7H,1-3H3;10H,7H2,1-6H3;9H,4-7H2,1-3H3;4-6H,1-3H3;4-7H2,1-3H3;7,9H,4-6H2,1-3H3;4-7H2,1-3H3;6,9H,5H2,1-4H3;2*4-6H,1-3H3;4-5H2,1-3H3;6,8H,1-5H3;8H,5-6H2,1-4H3;1-5H3;6H,1-4H3
InChIKeyNEFKKFFRIXGIBB-UHFFFAOYSA-N
XLogP43.01
TPSA318.17 Ų
H-Bond Donors11
H-Bond Acceptors34
Rotatable Bonds18
Heavy Atoms234
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003299.55
LogP ≤ 543.01
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine with MolForge

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Launch Full Analysis

Related Compounds

1-[5,6-bis[6-cyano-3-[2-(1,2,4-triazol-4-yl)ethyl]-3-azabicyclo[3.1.0]hexan-1-yl]-6-[5-[2-fluoro-4-[(5R)-2-oxo-5-(triazol-1-ylmethyl)-1,3-oxazolidin-3-yl]phenyl]-2-pyridinyl]hexyl]-3-[2-(1,2,4-triazol-4-yl)ethyl]-3-azabicyclo[3.1.0]hexane-6-carbonitrile
CID 87516882
1-[1-[[9-ethyl-2-(5-fluoroindol-1-yl)-6-morpholin-4-ylpurin-8-yl]methyl]piperidin-4-yl]-4-[[[1-[[2-(1H-indol-3-yl)-9-methyl-6-morpholin-4-ylpurin-8-yl]methyl]piperidin-4-yl]-methylamino]methyl]pyrrolidin-2-one
CID 90775981
1-[6-[[1-[5-[[7-[4-(4-chloro-1-methylimidazol-2-yl)phenyl]-1-(2-propan-2-yl-3-pyridinyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]methyl]-2-propan-2-yl-3-pyridinyl]-7-[4-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]methyl]-2-propan-2-yl-3-pyridinyl]-3,5-dimethyl-7-[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 154970495
cyclopropyl N-propan-2-ylcarbamate;1-(2,2-difluorocyclopropyl)-3-propan-2-ylurea;3,3-difluoro-N-propan-2-ylpiperidine-1-carboxamide;(2-fluoro-2-methylcyclopropyl) N-propan-2-ylcarbamate;3-fluoro-3-methyl-N-propan-2-ylpyrrolidine-1-carboxamide;1-[(3-fluoro-2-pyridinyl)methyl]-3-propan-2-ylurea;1-[(5-methyl-1H-pyrazol-3-yl)methyl]-3-propan-2-ylurea;1-[(4-methylpyrimidin-2-yl)methyl]-3-propan-2-ylurea;1-[(1-methyl-1,2,4-triazol-3-yl)methyl]-3-propan-2-ylurea;N-propan-2-yl-2-azabicyclo[2.2.1]heptane-2-carboxamide;N-propan-2-yl-5-azaspiro[2.4]heptane-5-carboxamide;N-propan-2-ylpiperidine-1-carboxamide
CID 157054312
tert-butyl 4-[6-[[2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetyl]amino]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl 4-[6-[[2-[4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetyl]amino]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl 4-[6-[[2-[4-[2-(trifluoromethyl)-4-pyridinyl]pyrazol-1-yl]acetyl]amino]-3-pyridinyl]piperazine-1-carboxylate;2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;N-(5-pyrazin-2-yl-2-pyridinyl)-2-(4-pyridin-4-ylimidazol-1-yl)acetamide;N-(5-pyrazin-2-yl-2-pyridinyl)-2-[4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;N-(5-pyrimidin-4-yl-2-pyridinyl)-2-[4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;N-(5-pyrimidin-5-yl-2-pyridinyl)-2-[4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide
CID 157175782
(9S)-5-(1-cyclopropylpyrazol-4-yl)-N-pyrazin-2-yl-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-pyrazin-2-yl-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-5-(5-fluoro-6-methyl-3-pyridinyl)-N-pyrazin-2-yl-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-N-pyrazin-2-yl-5-[2-(trifluoromethyl)pyrimidin-4-yl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide
CID 157217832
tert-butyl N-methyl-N-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)carbamate;tert-butyl N-methyl-N-(1-methyl-3-pyrimidin-5-ylpyrazol-5-yl)carbamate;3-tert-butyl-1-methyl-1-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)urea;tert-butyl N-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)carbamate;tert-butyl N-methyl-N-[1-pyridin-3-yl-3-(trifluoromethyl)pyrazol-4-yl]carbamate;tert-butyl N-methyl-N-[1-pyrimidin-5-yl-3-(trifluoromethyl)pyrazol-4-yl]carbamate;tert-butyl N-[1-pyridin-3-yl-3-(trifluoromethyl)pyrazol-4-yl]carbamate;tert-butyl N-[1-pyrimidin-5-yl-3-(trifluoromethyl)pyrazol-4-yl]carbamate
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Tert-butyl 4-[4-[1-[[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methyl]pyrazolo[4,5-b]pyridin-6-yl]pyrazol-1-yl]piperidine-1-carboxylate;6-(1-cyclohexylpyrazol-4-yl)-1-(imidazo[1,2-a]pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine;bis(6-(1-cyclohexylpyrazol-4-yl)-1-[[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methyl]pyrazolo[4,5-b]pyridine)
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1-tert-butylcyclohexene;6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole;6-tert-butyl-2-ethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-2-fluoro-[1,2,4]triazolo[1,5-a]pyridine;3-tert-butylimidazo[1,2-a]pyrimidine;3-tert-butyl-7-methylimidazo[1,2-a]pyrimidine;6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-1-methylpyrimidin-2-one;6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-(4-tert-butylpyrazol-1-yl)-5-fluoropyrimidine;2-(4-tert-butylpyrazol-1-yl)pyrimidine;3-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;7-tert-butyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine;2,6-ditert-butylpyrazolo[1,5-a]pyrimidine
CID 157364601
N-tert-butylacetamide;N-tert-butylcyclopropanecarboxamide;4-tert-butyl-1,3-dimethylpyrazole;4-tert-butyl-1,5-dimethylpyrazole;N-tert-butyl-2-methylpropanamide;N-tert-butyl-1-methylpyrazol-3-amine;N-tert-butyl-1-methylpyrazol-4-amine;N-tert-butyl-2-methylpyrazol-3-amine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;N-tert-butyloxetan-3-amine;N-tert-butylpropanamide;N-tert-butylpyridin-2-amine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;1,1-difluoro-2,2-dimethylpropane;N,2-dimethylpropan-2-amine;N-ethyl-2-methylpropan-2-amine;2-methylpropan-2-amine;2-methyl-N-(2,2,2-trifluoroethyl)propan-2-amine;1,1,1-trifluoro-2,2-dimethylpropane
CID 157378933
N-(3,3-difluorocyclobutyl)-5-(1-methylpyrazol-3-yl)-2-[3-(1-methylpyrazol-4-yl)phenyl]pyrimidin-4-amine;3-[2-[[5-(1-methylpyrazol-3-yl)-2-[3-(1-methylpyrazol-4-yl)phenyl]pyrimidin-4-yl]amino]ethyl]-1,3-oxazolidin-2-one;N'-[5-(1-methylpyrazol-4-yl)-2-[3-(1-methylpyrazol-4-yl)phenyl]pyrimidin-4-yl]butane-1,4-diamine;N'-[5-(1-methylpyrazol-4-yl)-2-[3-(1-methylpyrazol-4-yl)phenyl]pyrimidin-4-yl]propane-1,3-diamine
CID 157415743
5-[[(2R,5R)-2,5-dimethylpyrrolidin-1-yl]methyl]-2-methylpyridine;N-[2-(3,5-dimethyltriazol-4-yl)ethyl]-2-methylpropan-2-amine;N-[(1,5-dimethyl-1,2,4-triazol-3-yl)methyl]ethanamine;N-[(3,5-dimethyltriazol-4-yl)methyl]-N-ethylethanamine;2-ethyl-5-methylpyridine;5-ethyl-2-methylpyridine;N-ethyl-2-(6-methyl-3-pyridinyl)ethanamine;2-methyl-5-[(4-methylpiperidin-1-yl)methyl]pyridine;N-methyl-1-(6-methyl-3-pyridinyl)methanamine;bis(methyl 2-[(6-methyl-3-pyridinyl)methylamino]acetate);methyl 1-[(6-methyl-3-pyridinyl)methyl]piperidine-4-carboxylate;N-[(5-methyl-2-pyridinyl)methyl]ethanamine;2,2,2-trifluoro-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 157500897

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine?
The IUPAC name of 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine (CID 159755642) is 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine.
What is the SMILES notation for 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine?
The canonical SMILES for 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine is CC(C)(C)CCCNC(C)(C)C.CC(C)(C)CNC(C)(C)C.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCNCC1.CC(C)(C)N1CCOC1=O.CC(C)(C)N1CCOCC1.CC(C)(C)NCC1CC1.CC(C)(C)NCc1cccnc1.CC(C)(C)c1ccc(F)cc1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnc1.CC(C)(C)c1ncccn1.CC(C)(C)n1cccn1.CC(C)(C)n1ccnc1.CC(C)NC(C)(C)C.CC(F)CNC(C)(C)C.CCCNC(C)(C)C.CN(C)C(C)(C)C.CN(C)CCCNC(C)(C)C.CN1CCC(NC(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.CNC(C)(C)C.Cc1ncc(C(C)(C)C)n1C.
What is the InChIKey of 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine?
The InChIKey is NEFKKFFRIXGIBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N.C10H13F.C10H22N2.C10H16N2.C9H20N2.C9H16N2.C9H22N2.C9H13N.C9H19N.C9H13N.C9H21N.C8H18N2.C8H12N2.C8H17NO.2C8H17N.C7H16FN.2C7H12N2.C7H13NO2.2C7H17N.C6H15N.C5H13N/c1-10(2,3)8-7-9-12-11(4,5)6;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)11-9-5-7-12(4)8-6-9;1-10(2,3)12-8-9-5-4-6-11-7-9;1-9(2,3)11-7-5-10(4)6-8-11;1-7-10-6-8(11(7)5)9(2,3)4;1-9(2,3)10-7-6-8-11(4)5;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-10-9(4,5)6;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-9-5-4-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9-6-7-4-5-7;1-8(2,3)9-6-4-5-7-9;1-6(8)5-9-7(2,3)4;1-7(2,3)9-5-4-8-6-9;1-7(2,3)9-6-4-5-8-9;1-7(2,3)8-4-5-10-6(8)9;1-6(2)8-7(3,4)5;1-5-6-8-7(2,3)4;1-6(2,3)7(4)5;1-5(2,3)6-4/h12H,7-9H2,1-6H3;4-7H,1-3H3;9,11H,5-8H2,1-4H3;4-7,12H,8H2,1-3H3;5-8H2,1-4H3;6H,1-5H3;10H,6-8H2,1-5H3;4-7H,1-3H3;4-8H2,1-3H3;4-7H,1-3H3;10H,7H2,1-6H3;9H,4-7H2,1-3H3;4-6H,1-3H3;4-7H2,1-3H3;7,9H,4-6H2,1-3H3;4-7H2,1-3H3;6,9H,5H2,1-4H3;2*4-6H,1-3H3;4-5H2,1-3H3;6,8H,1-5H3;8H,5-6H2,1-4H3;1-5H3;6H,1-4H3.
What are the key properties of 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine?
5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine has a molecular weight of 3299.55 g/mol, XLogP of 43.01, 18 rotatable bonds, 11 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-1,2-dimethylimidazole;N-tert-butyl-4,4-dimethylpentan-1-amine;N-tert-butyl-2,2-dimethylpropan-1-amine;N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-tert-butyl-4-fluorobenzene;1-tert-butylimidazole;1-tert-butyl-4-methylpiperazine;N-tert-butyl-1-methylpiperidin-4-amine;4-tert-butylmorpholine;3-tert-butyl-1,3-oxazolidin-2-one;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;1-tert-butylpyrrolidine;N-(cyclopropylmethyl)-2-methylpropan-2-amine;N,2-dimethylpropan-2-amine;N-(2-fluoropropyl)-2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-propylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;N,N,2-trimethylpropan-2-amine is sourced from PubChem (CID 159755642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).