(4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine

C168H295FN24O14 — CID 167667572

IUPAC(4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine
SMILESC/N=C1\CC(C(C)(C)C)CCC1=CN.C=C(OC)N1CC(NC(C)C)C1.CC(C)C1CC(C)(O)C1.CC(C)C1CC2(CCOC2)C1.CC(C)COC1(C)CCOCC1.CC(C)COC1CCOCC1F.CC(C)C[C@H]1CCOC1.CC(C)NC1CC1c1cnn(C)c1.CC(C)NC1COC1.CC(C)Nc1ccccn1.CC(C)Nc1cccnc1.CC(C)Nc1ccncc1.CC(C)Nc1ncccn1.CC(C)c1cc2n(c1)C(=O)CCC2.CC(C)c1cc2n(c1)CCOC2.CC(C)c1cnn2c1COCC2.COC1CC(C(C)C)C1.COC1CC(NC(C)C)C1.Cc1cc(NC(C)C)ccn1
InChIInChI=1S/C12H22N2.C11H15NO.C10H17N3.C10H15NO.C10H20O2.C10H18O.C9H17FO2.C9H14N2O.C9H18N2O.C9H14N2.3C8H12N2.C8H17NO.3C8H16O.C7H11N3.C6H13NO/c1-12(2,3)10-6-5-9(8-13)11(7-10)14-4;1-8(2)9-6-10-4-3-5-11(13)12(10)7-9;1-7(2)12-10-4-9(10)8-5-11-13(3)6-8;1-8(2)9-5-10-7-12-4-3-11(10)6-9;1-9(2)8-12-10(3)4-6-11-7-5-10;1-8(2)9-5-10(6-9)3-4-11-7-10;1-7(2)5-12-9-3-4-11-6-8(9)10;1-7(2)8-5-10-11-3-4-12-6-9(8)11;1-7(2)10-9-5-11(6-9)8(3)12-4;1-7(2)11-9-4-5-10-8(3)6-9;1-7(2)10-8-3-5-9-6-4-8;1-7(2)10-8-4-3-5-9-6-8;1-7(2)10-8-5-3-4-6-9-8;1-6(2)9-7-4-8(5-7)10-3;1-6(2)7-4-8(5-7)9-3;1-6(2)7-4-8(3,9)5-7;1-7(2)5-8-3-4-9-6-8;1-6(2)10-7-8-4-3-5-9-7;1-5(2)7-6-3-8-4-6/h8,10H,5-7,13H2,1-4H3;6-8H,3-5H2,1-2H3;5-7,9-10,12H,4H2,1-3H3;5-6,8H,3-4,7H2,1-2H3;9H,4-8H2,1-3H3;8-9H,3-7H2,1-2H3;7-9H,3-6H2,1-2H3;5,7H,3-4,6H2,1-2H3;7,9-10H,3,5-6H2,1-2,4H3;4-7H,1-3H3,(H,10,11);3-7H,1-2H3,(H,9,10);3-7,10H,1-2H3;3-7H,1-2H3,(H,9,10);6-9H,4-5H2,1-3H3;6-8H,4-5H2,1-3H3;6-7,9H,4-5H2,1-3H3;7-8H,3-6H2,1-2H3;3-6H,1-2H3,(H,8,9,10);5-7H,3-4H2,1-2H3/b9-8?,14-11+;;;;;;;;;;;;;;;;;;/t;;;;;;;;;;;;;;;;8-;;/m................1../s1
InChIKeyWUPQXDVSDWASLO-RBZRXDSWSA-N
MW2894.36 g/mol
LogP34.24
Rot. Bonds37

About (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine

(4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine (PubChem CID 167667572) has the molecular formula C168H295FN24O14 and a molecular weight of 2894.36 g/mol. Its IUPAC name is (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine.

Molecular Properties

Compound Name(4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine
PubChem CID167667572
Molecular FormulaC168H295FN24O14
Molecular Weight2894.36 g/mol
Exact Mass2892.31
IUPAC Name(4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine
SMILESC/N=C1\CC(C(C)(C)C)CCC1=CN.C=C(OC)N1CC(NC(C)C)C1.CC(C)C1CC(C)(O)C1.CC(C)C1CC2(CCOC2)C1.CC(C)COC1(C)CCOCC1.CC(C)COC1CCOCC1F.CC(C)C[C@H]1CCOC1.CC(C)NC1CC1c1cnn(C)c1.CC(C)NC1COC1.CC(C)Nc1ccccn1.CC(C)Nc1cccnc1.CC(C)Nc1ccncc1.CC(C)Nc1ncccn1.CC(C)c1cc2n(c1)C(=O)CCC2.CC(C)c1cc2n(c1)CCOC2.CC(C)c1cnn2c1COCC2.COC1CC(C(C)C)C1.COC1CC(NC(C)C)C1.Cc1cc(NC(C)C)ccn1
InChIInChI=1S/C12H22N2.C11H15NO.C10H17N3.C10H15NO.C10H20O2.C10H18O.C9H17FO2.C9H14N2O.C9H18N2O.C9H14N2.3C8H12N2.C8H17NO.3C8H16O.C7H11N3.C6H13NO/c1-12(2,3)10-6-5-9(8-13)11(7-10)14-4;1-8(2)9-6-10-4-3-5-11(13)12(10)7-9;1-7(2)12-10-4-9(10)8-5-11-13(3)6-8;1-8(2)9-5-10-7-12-4-3-11(10)6-9;1-9(2)8-12-10(3)4-6-11-7-5-10;1-8(2)9-5-10(6-9)3-4-11-7-10;1-7(2)5-12-9-3-4-11-6-8(9)10;1-7(2)8-5-10-11-3-4-12-6-9(8)11;1-7(2)10-9-5-11(6-9)8(3)12-4;1-7(2)11-9-4-5-10-8(3)6-9;1-7(2)10-8-3-5-9-6-4-8;1-7(2)10-8-4-3-5-9-6-8;1-7(2)10-8-5-3-4-6-9-8;1-6(2)9-7-4-8(5-7)10-3;1-6(2)7-4-8(5-7)9-3;1-6(2)7-4-8(3,9)5-7;1-7(2)5-8-3-4-9-6-8;1-6(2)10-7-8-4-3-5-9-7;1-5(2)7-6-3-8-4-6/h8,10H,5-7,13H2,1-4H3;6-8H,3-5H2,1-2H3;5-7,9-10,12H,4H2,1-3H3;5-6,8H,3-4,7H2,1-2H3;9H,4-8H2,1-3H3;8-9H,3-7H2,1-2H3;7-9H,3-6H2,1-2H3;5,7H,3-4,6H2,1-2H3;7,9-10H,3,5-6H2,1-2,4H3;4-7H,1-3H3,(H,10,11);3-7H,1-2H3,(H,9,10);3-7,10H,1-2H3;3-7H,1-2H3,(H,9,10);6-9H,4-5H2,1-3H3;6-8H,4-5H2,1-3H3;6-7,9H,4-5H2,1-3H3;7-8H,3-6H2,1-2H3;3-6H,1-2H3,(H,8,9,10);5-7H,3-4H2,1-2H3/b9-8?,14-11+;;;;;;;;;;;;;;;;;;/t;;;;;;;;;;;;;;;;8-;;/m................1../s1
InChIKeyWUPQXDVSDWASLO-RBZRXDSWSA-N
XLogP34.24
TPSA420.79 Ų
H-Bond Donors11
H-Bond Acceptors38
Rotatable Bonds37
Heavy Atoms207
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002894.36
LogP ≤ 534.24
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[5-chloro-3-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-3-phenylpropanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R,5R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-[(2S)-oxolan-2-yl]propanamide;N-[5-(hydroxymethyl)-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide
CID 157062913
1-benzyl-2-propan-2-ylpyrrolidine;tert-butyl 3,3-difluoro-5-propan-2-ylpiperidine-1-carboxylate;tert-butyl 3-methyl-3-propan-2-ylazetidine-1-carboxylate;tert-butyl 3-propan-2-ylazetidine-1-carboxylate;tert-butyl N-[(4-propan-2-yloxan-4-yl)methyl]carbamate;tert-butyl 4-propan-2-ylpiperidine-1-carboxylate;1-methyl-4-(2-propan-2-yloxolan-2-yl)pyrazole;methyl 3-propan-2-ylpiperidine-1-carboxylate;4-phenyl-4-propan-2-yloxane;3-phenyl-3-propan-2-yloxetane;4-propan-2-yloxane-4-carbonitrile;1-(3-propan-2-ylpiperidin-1-yl)pentan-1-one;1-propan-2-ylpyrrolidin-3-ol;2-[(2-propan-2-ylpyrrolidin-1-yl)methyl]pyrazine;3-[(2-propan-2-ylpyrrolidin-1-yl)methyl]pyridine;2-[(2-propan-2-ylpyrrolidin-1-yl)methyl]pyrimidine;4-propan-2-yl-4-(trifluoromethyl)oxane;1-[4-propan-2-yl-4-(trifluoromethyl)piperidin-1-yl]ethanone
CID 159519216
N-[5-chloro-3-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-3-phenylpropanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R,5R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-[(2S)-oxolan-2-yl]propanamide;N-[5-(hydroxymethyl)-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide
CID 160421447
(2R)-3-[1-(difluoromethyl)pyrazol-4-yl]-N-[1-[5-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-3-(trifluoromethyl)pyrazol-1-yl]-2-methylpropan-2-yl]-2-[(2R,3R)-2-[6-[2-(methoxymethyl)imidazo[1,2-a]pyrimidin-6-yl]-2-methyl-3-pyridinyl]-4-oxo-5-azaspiro[2.4]heptan-5-yl]propanamide
CID 177907325
(2R)-3-[1-(difluoromethyl)pyrazol-4-yl]-N-[1-[5-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]-3-(trifluoromethyl)pyrazol-1-yl]-2-methylpropan-2-yl]-2-[(2R,3R)-2-[6-[2-(methoxymethyl)imidazo[1,2-a]pyrimidin-6-yl]-2-methyl-3-pyridinyl]-4-oxo-5-azaspiro[2.4]heptan-5-yl]propanamide
CID 178066726
(2S)-1-prop-2-enoyl-5-[2-[4-[(3S)-1-prop-2-enoylpiperidine-3-carbonyl]morpholin-2-yl]-4-pyrazolo[1,5-b]pyridazin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[3-(4-pyrazolo[1,5-b]pyridazin-3-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)cyclobutyl]pyrrolidine-2-carboxamide
CID 138500250
1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-3-cyclopropyl-3-(8-methylimidazo[1,5-a]pyridin-3-yl)butan-1-one;1-[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-3-(4,6-dimethyl-3-pyridinyl)-3-methylbutan-1-one;1-[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-3-methyl-3-(8-methylindolizin-3-yl)butan-1-one;(1R,5S)-N-[2-(3,4-dihydro-1H-isochromen-4-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1R,5S)-N-[4-(8-methylimidazo[1,5-a]pyridin-3-yl)oxan-4-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-(1-methyl-4,5,6,7-tetrahydroindazol-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 157134906
(3R)-1-[3-fluoro-1-methyl-3-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyridinyl]cyclobutyl]-3-[6-(4-methylpyrazol-1-yl)-3-pyridinyl]butan-1-one;3-hydroxy-1-methoxy-3-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-pyridinyl]-N-[(2S)-1-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]propan-2-yl]cyclobutane-1-carboxamide;1-methoxy-3-[6-methyl-2-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-4-yl]-N-[(1S)-1-[5-(4-methylpyrazol-1-yl)pyrazin-2-yl]ethyl]cyclobutane-1-carboxamide;1-methoxy-3-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]-1,3,5-triazin-2-yl]-N-[(1S)-1-[6-(4-methylpyrazol-1-yl)-3-pyridinyl]ethyl]cyclobutane-1-carboxamide
CID 157190415
3-tert-butyl-3,4-dihydro-1H-isochromene;6-tert-butyl-1-methyl-4,5,6,7-tetrahydroindazole;2,3-dimethylbutylbenzene;3-fluoro-4-(2-methylpropoxy)oxane;4-methyl-4-(2-methylpropoxy)oxane;2-methyl-N-propan-2-ylpyridin-4-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;6-propan-2-yl-2,3-dihydro-1H-pyrrolizine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;3-propan-2-yl-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole;2-propan-2-yl-6-oxaspiro[3.4]octane;(3S)-N-propan-2-yloxolan-3-amine;3-propan-2-ylpyrazolo[1,5-a]pyridine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine;6-propan-2-yl-3H-pyrrolizine
CID 157431646
N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)-5-[(6-morpholin-4-yl-2-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2S)-2-hydroxycyclobutyl]-7-(methylamino)-5-[[6-[(3S)-oxan-3-yl]-2-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2S)-2-hydroxycyclobutyl]-7-(methylamino)-5-[[6-[(3R)-oxan-3-yl]-2-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-[(1R,2S)-2-methylcyclobutyl]-5-[[6-[(2S)-oxan-2-yl]-2-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 158161596
3-tert-butyl-3,4-dihydro-1H-isochromene;(4-tert-butyl-2-methyliminocyclohexylidene)methanamine;2,3-dimethylbutylbenzene;3-fluoro-4-(2-methylpropoxy)oxane;4-methyl-4-(2-methylpropoxy)oxane;2-methyl-N-propan-2-ylpyridin-4-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;6-propan-2-yl-2,3-dihydro-1H-pyrrolizine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;3-propan-2-yl-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole;2-propan-2-yl-6-oxaspiro[3.4]octane;(3S)-N-propan-2-yloxolan-3-amine;3-propan-2-ylpyrazolo[1,5-a]pyridine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine;6-propan-2-yl-3H-pyrrolizine
CID 158287561
1-ethyl-4-[(2-methylpropan-2-yl)oxymethyl]pyrazole;(1S,5R)-3-(1-fluoroethyl)-6-[(2-methylpropan-2-yl)oxymethyl]-3-azabicyclo[3.1.0]hexane;(1S,5R)-3-(2-fluoropropyl)-6-[(2-methylpropan-2-yl)oxymethyl]-3-azabicyclo[3.1.0]hexane;(4S)-2-methylidene-4-[(2-methylpropan-2-yl)oxymethyl]piperidine;1-methyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]pyrazole;2-methyl-5-[(2-methylpropan-2-yl)oxymethyl]-1H-imidazole;3-methyl-3-[(2-methylpropan-2-yl)oxymethyl]oxetane;1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]pyrazole;5-methyl-3-[(2-methylpropan-2-yl)oxymethyl]-1H-pyrazole;(2-methylpropan-2-yl)oxymethylbenzene;(2-methylpropan-2-yl)oxymethylcyclopropane;4-[(2-methylpropan-2-yl)oxymethyl]piperidine;(4R)-4-[(2-methylpropan-2-yl)oxymethyl]piperidin-2-one;4-[(2-methylpropan-2-yl)oxymethyl]-2H-pyrrole;3-[(2-methylpropan-2-yl)oxy]-1-propylazetidine;1-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]propan-2-one
CID 158428371

Frequently Asked Questions

What is the IUPAC name of (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine?
The IUPAC name of (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine (CID 167667572) is (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine.
What is the SMILES notation for (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine?
The canonical SMILES for (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine is C/N=C1\CC(C(C)(C)C)CCC1=CN.C=C(OC)N1CC(NC(C)C)C1.CC(C)C1CC(C)(O)C1.CC(C)C1CC2(CCOC2)C1.CC(C)COC1(C)CCOCC1.CC(C)COC1CCOCC1F.CC(C)C[C@H]1CCOC1.CC(C)NC1CC1c1cnn(C)c1.CC(C)NC1COC1.CC(C)Nc1ccccn1.CC(C)Nc1cccnc1.CC(C)Nc1ccncc1.CC(C)Nc1ncccn1.CC(C)c1cc2n(c1)C(=O)CCC2.CC(C)c1cc2n(c1)CCOC2.CC(C)c1cnn2c1COCC2.COC1CC(C(C)C)C1.COC1CC(NC(C)C)C1.Cc1cc(NC(C)C)ccn1.
What is the InChIKey of (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine?
The InChIKey is WUPQXDVSDWASLO-RBZRXDSWSA-N. The full InChI is InChI=1S/C12H22N2.C11H15NO.C10H17N3.C10H15NO.C10H20O2.C10H18O.C9H17FO2.C9H14N2O.C9H18N2O.C9H14N2.3C8H12N2.C8H17NO.3C8H16O.C7H11N3.C6H13NO/c1-12(2,3)10-6-5-9(8-13)11(7-10)14-4;1-8(2)9-6-10-4-3-5-11(13)12(10)7-9;1-7(2)12-10-4-9(10)8-5-11-13(3)6-8;1-8(2)9-5-10-7-12-4-3-11(10)6-9;1-9(2)8-12-10(3)4-6-11-7-5-10;1-8(2)9-5-10(6-9)3-4-11-7-10;1-7(2)5-12-9-3-4-11-6-8(9)10;1-7(2)8-5-10-11-3-4-12-6-9(8)11;1-7(2)10-9-5-11(6-9)8(3)12-4;1-7(2)11-9-4-5-10-8(3)6-9;1-7(2)10-8-3-5-9-6-4-8;1-7(2)10-8-4-3-5-9-6-8;1-7(2)10-8-5-3-4-6-9-8;1-6(2)9-7-4-8(5-7)10-3;1-6(2)7-4-8(5-7)9-3;1-6(2)7-4-8(3,9)5-7;1-7(2)5-8-3-4-9-6-8;1-6(2)10-7-8-4-3-5-9-7;1-5(2)7-6-3-8-4-6/h8,10H,5-7,13H2,1-4H3;6-8H,3-5H2,1-2H3;5-7,9-10,12H,4H2,1-3H3;5-6,8H,3-4,7H2,1-2H3;9H,4-8H2,1-3H3;8-9H,3-7H2,1-2H3;7-9H,3-6H2,1-2H3;5,7H,3-4,6H2,1-2H3;7,9-10H,3,5-6H2,1-2,4H3;4-7H,1-3H3,(H,10,11);3-7H,1-2H3,(H,9,10);3-7,10H,1-2H3;3-7H,1-2H3,(H,9,10);6-9H,4-5H2,1-3H3;6-8H,4-5H2,1-3H3;6-7,9H,4-5H2,1-3H3;7-8H,3-6H2,1-2H3;3-6H,1-2H3,(H,8,9,10);5-7H,3-4H2,1-2H3/b9-8?,14-11+;;;;;;;;;;;;;;;;;;/t;;;;;;;;;;;;;;;;8-;;/m................1../s1.
What are the key properties of (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine?
(4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine has a molecular weight of 2894.36 g/mol, XLogP of 34.24, 37 rotatable bonds, 11 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for (4-tert-butyl-2-methyliminocyclohexylidene)methanamine;3-fluoro-4-(2-methylpropoxy)oxane;1-(1-methoxyethenyl)-N-propan-2-ylazetidin-3-amine;3-methoxy-N-propan-2-ylcyclobutan-1-amine;1-methoxy-3-propan-2-ylcyclobutane;4-methyl-4-(2-methylpropoxy)oxane;1-methyl-3-propan-2-ylcyclobutan-1-ol;2-methyl-N-propan-2-ylpyridin-4-amine;(3S)-3-(2-methylpropyl)oxolane;2-(1-methylpyrazol-4-yl)-N-propan-2-ylcyclopropan-1-amine;2-propan-2-yl-7,8-dihydro-6H-indolizin-5-one;3-propan-2-yl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;7-propan-2-yl-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine;2-propan-2-yl-6-oxaspiro[3.4]octane;N-propan-2-yloxetan-3-amine;N-propan-2-ylpyridin-2-amine;N-propan-2-ylpyridin-3-amine;N-propan-2-ylpyridin-4-amine;N-propan-2-ylpyrimidin-2-amine is sourced from PubChem (CID 167667572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).