5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one

C111H135N25O8 — CID 161103240

IUPAC5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one
SMILESCCCn1cc(-n2cc(-c3ccc(NC4COC4)nc3C)cn2)ccc1=O.Cc1cc(NC2CCC2)ncc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1cc(NC2CCOC2)ncc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1nc(NC2CC3(CCC3)C2)ccc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1nc(NC2CCOC2)ccc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1
InChIInChI=1S/C25H31N5O.2C22H27N5O2.C22H27N5O.C20H23N5O2/c1-17(2)14-29-16-21(5-8-24(29)31)30-15-19(13-26-30)22-6-7-23(27-18(22)3)28-20-11-25(12-20)9-4-10-25;1-15(2)11-26-13-19(4-7-22(26)28)27-12-17(10-23-27)20-5-6-21(24-16(20)3)25-18-8-9-29-14-18;1-15(2)11-26-13-19(4-5-22(26)28)27-12-17(9-24-27)20-10-23-21(8-16(20)3)25-18-6-7-29-14-18;1-15(2)12-26-14-19(7-8-22(26)28)27-13-17(10-24-27)20-11-23-21(9-16(20)3)25-18-5-4-6-18;1-3-8-24-11-17(4-7-20(24)26)25-10-15(9-21-25)18-5-6-19(22-14(18)2)23-16-12-27-13-16/h5-8,13,15-17,20H,4,9-12,14H2,1-3H3,(H,27,28);4-7,10,12-13,15,18H,8-9,11,14H2,1-3H3,(H,24,25);4-5,8-10,12-13,15,18H,6-7,11,14H2,1-3H3,(H,23,25);7-11,13-15,18H,4-6,12H2,1-3H3,(H,23,25);4-7,9-11,16H,3,8,12-13H2,1-2H3,(H,22,23)
InChIKeyUISBSSJXMKVQRA-UHFFFAOYSA-N
MW1947.47 g/mol
LogP17.98
Rot. Bonds30

About 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one

5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one (PubChem CID 161103240) has the molecular formula C111H135N25O8 and a molecular weight of 1947.47 g/mol. Its IUPAC name is 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one.

Molecular Properties

Compound Name5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one
PubChem CID161103240
Molecular FormulaC111H135N25O8
Molecular Weight1947.47 g/mol
Exact Mass1946.09
IUPAC Name5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one
SMILESCCCn1cc(-n2cc(-c3ccc(NC4COC4)nc3C)cn2)ccc1=O.Cc1cc(NC2CCC2)ncc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1cc(NC2CCOC2)ncc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1nc(NC2CC3(CCC3)C2)ccc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1nc(NC2CCOC2)ccc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1
InChIInChI=1S/C25H31N5O.2C22H27N5O2.C22H27N5O.C20H23N5O2/c1-17(2)14-29-16-21(5-8-24(29)31)30-15-19(13-26-30)22-6-7-23(27-18(22)3)28-20-11-25(12-20)9-4-10-25;1-15(2)11-26-13-19(4-7-22(26)28)27-12-17(10-23-27)20-5-6-21(24-16(20)3)25-18-8-9-29-14-18;1-15(2)11-26-13-19(4-5-22(26)28)27-12-17(9-24-27)20-10-23-21(8-16(20)3)25-18-6-7-29-14-18;1-15(2)12-26-14-19(7-8-22(26)28)27-13-17(10-24-27)20-11-23-21(9-16(20)3)25-18-5-4-6-18;1-3-8-24-11-17(4-7-20(24)26)25-10-15(9-21-25)18-5-6-19(22-14(18)2)23-16-12-27-13-16/h5-8,13,15-17,20H,4,9-12,14H2,1-3H3,(H,27,28);4-7,10,12-13,15,18H,8-9,11,14H2,1-3H3,(H,24,25);4-5,8-10,12-13,15,18H,6-7,11,14H2,1-3H3,(H,23,25);7-11,13-15,18H,4-6,12H2,1-3H3,(H,23,25);4-7,9-11,16H,3,8,12-13H2,1-2H3,(H,22,23)
InChIKeyUISBSSJXMKVQRA-UHFFFAOYSA-N
XLogP17.98
TPSA351.39 Ų
H-Bond Donors5
H-Bond Acceptors33
Rotatable Bonds30
Heavy Atoms144
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001947.47
LogP ≤ 517.98
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1033

Analyze 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one with MolForge

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Related Compounds

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
1-[[6-(3-azabicyclo[3.1.0]hexan-3-yl)-2-methyl-3-pyridinyl]methyl]-N-[(6R)-3-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl]pyrazole-4-carboxamide;1-[[6-(5-azaspiro[2.3]hexan-5-yl)-2-methyl-3-pyridinyl]methyl]-N-[(6R)-3-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl]pyrazole-4-carboxamide;1-[[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-methyl-3-pyridinyl]methyl]-N-[(6R)-3-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl]pyrazole-4-carboxamide
CID 157923531
1-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-N-(3,3-difluorocyclobutyl)piperidine-4-carboxamide;1-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-N-ethoxypiperidine-4-carboxamide;bis(1-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-N-(3-methoxycyclobutyl)piperidine-4-carboxamide);1-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-N-(2-methoxypropyl)piperidine-4-carboxamide;1-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-N-methyl-N-(2-methylpropyl)piperidine-4-carboxamide;1-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-N-(2,2,2-trifluoroethyl)piperidine-4-carboxamide;1-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-N-(3,3,3-trifluoropropyl)piperidine-4-carboxamide
CID 158423532
4-tert-butyl-5-chloro-N-(1,4-dimethylpyrazol-5-yl)pyridin-2-amine;4-tert-butyl-5-chloro-N-(2,5-dimethylpyrazol-3-yl)pyridin-2-amine;4-tert-butyl-5-chloro-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-tert-butyl-5-chloro-N-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;4-tert-butyl-5-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine;4-tert-butyl-5-methyl-N-(oxetan-3-yl)pyrimidin-2-amine;4-tert-butyl-5-methyl-N-(oxolan-3-yl)pyrimidin-2-amine;4-tert-butyl-5-methyl-N-(1-propan-2-ylpiperidin-4-yl)pyridin-2-amine;1-[4-[(4-tert-butyl-5-methyl-2-pyridinyl)amino]piperidin-1-yl]ethanone;4-tert-butyl-N-(oxan-4-yl)pyridin-2-amine
CID 159870030
1-[2-(cyclohexylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(2-ethoxyethyl)-6-oxo-N-[5-[3-piperidin-1-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;1-[3-(2-methoxyethylamino)-3-oxopropyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(2-methoxyethyl)-6-oxo-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide;1-[3-(2-morpholin-4-ylethylamino)-3-oxopropyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide
CID 160119109
N-(2,2-difluorocyclobutyl)-5-[1-[(3S,4S)-3-methoxyoxan-4-yl]pyrrolo[2,3-b]pyridin-3-yl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-difluorocyclobutyl)-5-[1-[(3R,4R)-3-methoxyoxan-4-yl]pyrrolo[2,3-b]pyridin-3-yl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S)-2,2-difluorocyclobutyl]-7-(methylamino)-5-[1-(oxan-4-yl)pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1R)-2,2-difluorocyclobutyl]-7-(methylamino)-5-[1-(oxan-4-yl)pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167539866
N-[(1S)-2,2-difluorocyclobutyl]-7-(methylamino)-5-[1-[(3R)-1-methylpyrrolidin-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1R)-2,2-difluorocyclobutyl]-7-(methylamino)-5-[1-[(3R)-1-methylpyrrolidin-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-difluorocyclobutyl)-7-(methylamino)-5-[1-[(3S)-1-methylpyrrolidin-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-difluorocyclobutyl)-7-(methylamino)-5-[1-[(3R)-1-methylpyrrolidin-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1R)-2,2-difluorocyclobutyl]-7-(methylamino)-5-[1-[(3S)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167565769
4-tert-butyl-5-chloro-N-(1,4-dimethylpyrazol-5-yl)pyridin-2-amine;4-tert-butyl-5-chloro-N-(2,5-dimethylpyrazol-3-yl)pyridin-2-amine;4-tert-butyl-5-chloro-N-(1-methylpiperidin-4-yl)pyridin-2-amine;4-tert-butyl-5-chloro-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-tert-butyl-5-chloro-N-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;4-tert-butyl-5-chloro-N-(1-propan-2-ylpiperidin-4-yl)pyridin-2-amine;1-[4-[(4-tert-butyl-5-chloro-2-pyridinyl)amino]piperidin-1-yl]ethanone;4-tert-butyl-5-methyl-N-(oxetan-3-yl)pyrimidin-2-amine;4-tert-butyl-5-methyl-N-(oxolan-3-yl)pyrimidin-2-amine;4-tert-butyl-N-(oxan-4-yl)pyridin-2-amine
CID 167589242
N-[(1R)-2,2-difluorocyclobutyl]-7-(methylamino)-5-[1-[(3R)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S)-2,2-difluorocyclobutyl]-7-(methylamino)-5-[1-[(3R)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S)-2,2-difluorocyclobutyl]-7-(methylamino)-5-[1-[(3S)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-difluorocyclobutyl)-7-(methylamino)-5-[1-[(3R)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-difluorocyclobutyl)-7-(methylamino)-5-[1-[(3S)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167681457
5-[[3-Amino-2-[6-(tert-butylamino)-4-(trifluoromethyl)-3-pyridinyl]prop-2-enylidene]amino]-1-propylpyridin-2-one;5-[[3-amino-2-[6-(cyclopentylamino)-4-(trifluoromethyl)-3-pyridinyl]prop-2-enylidene]amino]-1-propylpyridin-2-one;5-[4-[4-chloro-6-(oxan-4-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-chloro-6-(oxan-4-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[4-chloro-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[4-methyl-6-[(1-methylcyclopropyl)amino]-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one
CID 168388917
1-(oxan-4-yl)-6-[(1R,2R)-2-pyridin-2-ylcyclobutyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxan-4-yl)-6-[(1S,2S)-2-pyridin-2-ylcyclobutyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxan-4-yl)-6-(2-pyridin-2-ylcyclobutyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxan-4-yl)-6-[(1R,2S)-2-pyrimidin-2-ylcyclobutyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxan-4-yl)-6-[(1S,2R)-2-pyrimidin-2-ylcyclobutyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one
CID 157102780
7-[benzyl(methyl)amino]-5-(1-cyclopropylpyrrolo[2,3-b]pyridin-3-yl)-N-[(2S)-2-methoxycyclobutyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[benzyl(methyl)amino]-5-(1-cyclopropylpyrrolo[2,3-b]pyridin-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(1-cyclopropylpyrrolo[2,3-b]pyridin-3-yl)-N-[(2S)-2-methoxycyclobutyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;trans-(1S,2S)-2-methoxycyclobutan-1-amine
CID 157243074

Frequently Asked Questions

What is the IUPAC name of 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one?
The IUPAC name of 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one (CID 161103240) is 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one.
What is the SMILES notation for 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one?
The canonical SMILES for 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one is CCCn1cc(-n2cc(-c3ccc(NC4COC4)nc3C)cn2)ccc1=O.Cc1cc(NC2CCC2)ncc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1cc(NC2CCOC2)ncc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1nc(NC2CC3(CCC3)C2)ccc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.Cc1nc(NC2CCOC2)ccc1-c1cnn(-c2ccc(=O)n(CC(C)C)c2)c1.
What is the InChIKey of 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one?
The InChIKey is UISBSSJXMKVQRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31N5O.2C22H27N5O2.C22H27N5O.C20H23N5O2/c1-17(2)14-29-16-21(5-8-24(29)31)30-15-19(13-26-30)22-6-7-23(27-18(22)3)28-20-11-25(12-20)9-4-10-25;1-15(2)11-26-13-19(4-7-22(26)28)27-12-17(10-23-27)20-5-6-21(24-16(20)3)25-18-8-9-29-14-18;1-15(2)11-26-13-19(4-5-22(26)28)27-12-17(9-24-27)20-10-23-21(8-16(20)3)25-18-6-7-29-14-18;1-15(2)12-26-14-19(7-8-22(26)28)27-13-17(10-24-27)20-11-23-21(9-16(20)3)25-18-5-4-6-18;1-3-8-24-11-17(4-7-20(24)26)25-10-15(9-21-25)18-5-6-19(22-14(18)2)23-16-12-27-13-16/h5-8,13,15-17,20H,4,9-12,14H2,1-3H3,(H,27,28);4-7,10,12-13,15,18H,8-9,11,14H2,1-3H3,(H,24,25);4-5,8-10,12-13,15,18H,6-7,11,14H2,1-3H3,(H,23,25);7-11,13-15,18H,4-6,12H2,1-3H3,(H,23,25);4-7,9-11,16H,3,8,12-13H2,1-2H3,(H,22,23).
What are the key properties of 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one?
5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one has a molecular weight of 1947.47 g/mol, XLogP of 17.98, 30 rotatable bonds, 5 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[6-(cyclobutylamino)-4-methyl-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[2-methyl-6-(oxetan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-propylpyridin-2-one;5-[4-[2-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;5-[4-[4-methyl-6-(oxolan-3-ylamino)-3-pyridinyl]pyrazol-1-yl]-1-(2-methylpropyl)pyridin-2-one;1-(2-methylpropyl)-5-[4-[2-methyl-6-(spiro[3.3]heptan-2-ylamino)-3-pyridinyl]pyrazol-1-yl]pyridin-2-one is sourced from PubChem (CID 161103240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).