4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide

C86H95F5N24O3 — CID 160786969

IUPAC4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide
SMILESCc1cc(C)n(-c2cc(N3CC4(COC4)C3)nc(Cc3ccc(F)c(F)c3)n2)n1.Cc1cc(C)n(-c2cc(N3C[C@H]4C[C@@H]3CN4)nc(Nc3ccc(C)c(F)c3)n2)n1.Cc1cc(C)n(-c2nc(Cc3ccc(C)c(F)c3)cc(N3CC4(COC4)C3)n2)n1.Cc1ccc(Cc2nc(N3CCNC(C(N)=O)C3)cc(-n3nc(C)cc3C)n2)c(F)c1
InChIInChI=1S/C22H26FN7O.C22H24FN5O.C21H21F2N5O.C21H24FN7/c1-13-4-5-16(17(23)8-13)10-19-26-20(29-7-6-25-18(12-29)22(24)31)11-21(27-19)30-15(3)9-14(2)28-30;1-14-4-5-17(8-19(14)23)7-18-9-20(27-10-22(11-27)12-29-13-22)25-21(24-18)28-16(3)6-15(2)26-28;1-13-5-14(2)28(26-13)20-8-19(27-9-21(10-27)11-29-12-21)24-18(25-20)7-15-3-4-16(22)17(23)6-15;1-12-4-5-15(8-18(12)22)24-21-25-19(28-11-16-7-17(28)10-23-16)9-20(26-21)29-14(3)6-13(2)27-29/h4-5,8-9,11,18,25H,6-7,10,12H2,1-3H3,(H2,24,31);4-6,8-9H,7,10-13H2,1-3H3;3-6,8H,7,9-12H2,1-2H3;4-6,8-9,16-17,23H,7,10-11H2,1-3H3,(H,24,25,26)/t;;;16-,17-/m...1/s1
InChIKeySBIJLJSTMLMOGN-RGXXVGJFSA-N
MW1607.86 g/mol
LogP10.74
Rot. Bonds17

About 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide

4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide (PubChem CID 160786969) has the molecular formula C86H95F5N24O3 and a molecular weight of 1607.86 g/mol. Its IUPAC name is 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide.

Molecular Properties

Compound Name4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide
PubChem CID160786969
Molecular FormulaC86H95F5N24O3
Molecular Weight1607.86 g/mol
Exact Mass1606.79
IUPAC Name4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide
SMILESCc1cc(C)n(-c2cc(N3CC4(COC4)C3)nc(Cc3ccc(F)c(F)c3)n2)n1.Cc1cc(C)n(-c2cc(N3C[C@H]4C[C@@H]3CN4)nc(Nc3ccc(C)c(F)c3)n2)n1.Cc1cc(C)n(-c2nc(Cc3ccc(C)c(F)c3)cc(N3CC4(COC4)C3)n2)n1.Cc1ccc(Cc2nc(N3CCNC(C(N)=O)C3)cc(-n3nc(C)cc3C)n2)c(F)c1
InChIInChI=1S/C22H26FN7O.C22H24FN5O.C21H21F2N5O.C21H24FN7/c1-13-4-5-16(17(23)8-13)10-19-26-20(29-7-6-25-18(12-29)22(24)31)11-21(27-19)30-15(3)9-14(2)28-30;1-14-4-5-17(8-19(14)23)7-18-9-20(27-10-22(11-27)12-29-13-22)25-21(24-18)28-16(3)6-15(2)26-28;1-13-5-14(2)28(26-13)20-8-19(27-9-21(10-27)11-29-12-21)24-18(25-20)7-15-3-4-16(22)17(23)6-15;1-12-4-5-15(8-18(12)22)24-21-25-19(28-11-16-7-17(28)10-23-16)9-20(26-21)29-14(3)6-13(2)27-29/h4-5,8-9,11,18,25H,6-7,10,12H2,1-3H3,(H2,24,31);4-6,8-9H,7,10-13H2,1-3H3;3-6,8H,7,9-12H2,1-2H3;4-6,8-9,16-17,23H,7,10-11H2,1-3H3,(H,24,25,26)/t;;;16-,17-/m...1/s1
InChIKeySBIJLJSTMLMOGN-RGXXVGJFSA-N
XLogP10.74
TPSA285.00 Ų
H-Bond Donors4
H-Bond Acceptors26
Rotatable Bonds17
Heavy Atoms118
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001607.86
LogP ≤ 510.74
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1026

Analyze 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide with MolForge

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Related Compounds

3-[[6-(3,4-difluoroanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]amino]butan-2-one;1-[4-[6-[(3,4-difluorophenyl)methyl]-2-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]ethanone;1-[(2R)-4-[6-[(2,4-difluorophenyl)methyl]-2-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]piperazin-2-yl]ethanone;1-[(2S)-4-[6-[(2,4-difluorophenyl)methyl]-2-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]piperazin-2-yl]ethanone
CID 157341916
4-[6-(2,4-difluoroanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]piperazine-2-carboxamide;(2R)-4-[2-(3,5-dimethylpyrazol-1-yl)-6-(2-fluoro-4-methylanilino)pyrimidin-4-yl]piperazine-2-carboxamide;(2S)-4-[2-(3,5-dimethylpyrazol-1-yl)-6-(2-fluoro-4-methylanilino)pyrimidin-4-yl]piperazine-2-carboxamide
CID 158436544
4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(2-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(2,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;1-[4-[2-[(2,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanone;1-[4-[2-(3,5-dimethylpyrazol-1-yl)-6-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]ethanone
CID 160974842
1-[4-[2-[(3,4-Difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanone;1-[4-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]ethanone;1-[4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(4-fluorophenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]ethanone;1-[4-[2-(3,5-dimethylpyrazol-1-yl)-6-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]ethanone
CID 160977854
3-[[6-(4-chloroanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]amino]butan-2-one;6-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-2-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-4-amine;3-[[2-(3,4-difluoroanilino)-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]amino]butan-2-one;1-[4-[6-[(2,4-difluorophenyl)methyl]-2-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]piperazin-2-yl]ethanone
CID 161699513
N-[4-[(3S)-3-[2-ethoxyethyl(methyl)amino]piperidin-1-yl]-3-fluorophenyl]-5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-amine;N-[3-fluoro-4-[4-[[methyl(2-morpholin-4-ylethyl)amino]methyl]piperidin-1-yl]phenyl]-5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-amine;N-[3-fluoro-4-[(3S)-3-[methyl(2-morpholin-4-ylethyl)amino]piperidin-1-yl]phenyl]-5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-amine;N-[(3S)-1-[2-fluoro-4-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]amino]phenyl]piperidin-3-yl]-3-isocyano-N-methylpropanamide;7-[2-fluoro-4-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]methyl]phenyl]-2,7-diazaspiro[3.5]nonane;2-[7-[2-fluoro-4-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]methyl]phenyl]-2,7-diazaspiro[3.5]nonan-2-yl]ethanol;N-[3-fluoro-4-[(3S)-3-[methyl(propyl)amino]piperidin-1-yl]phenyl]-5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-amine
CID 167630292
N-[4-[(3S)-3-[2-ethoxyethyl(methyl)amino]piperidin-1-yl]-3-fluorophenyl]-5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-amine;N-[(3S)-1-[2-fluoro-4-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]amino]phenyl]piperidin-3-yl]-3-isocyano-N-methylpropanamide;7-[2-fluoro-4-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]methyl]phenyl]-2,7-diazaspiro[3.5]nonane;4-[7-[2-fluoro-4-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]methyl]phenyl]-2,7-diazaspiro[3.5]nonan-2-yl]butan-1-ol;2-[7-[2-fluoro-4-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]methyl]phenyl]-2,7-diazaspiro[3.5]nonan-2-yl]ethanol;3-[7-[2-fluoro-4-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]methyl]phenyl]-2,7-diazaspiro[3.5]nonan-2-yl]propan-1-ol;N-[3-fluoro-4-[(3S)-3-[methyl(propyl)amino]piperidin-1-yl]phenyl]-5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-amine
CID 167707087

Frequently Asked Questions

What is the IUPAC name of 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide?
The IUPAC name of 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide (CID 160786969) is 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide.
What is the SMILES notation for 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide?
The canonical SMILES for 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide is Cc1cc(C)n(-c2cc(N3CC4(COC4)C3)nc(Cc3ccc(F)c(F)c3)n2)n1.Cc1cc(C)n(-c2cc(N3C[C@H]4C[C@@H]3CN4)nc(Nc3ccc(C)c(F)c3)n2)n1.Cc1cc(C)n(-c2nc(Cc3ccc(C)c(F)c3)cc(N3CC4(COC4)C3)n2)n1.Cc1ccc(Cc2nc(N3CCNC(C(N)=O)C3)cc(-n3nc(C)cc3C)n2)c(F)c1.
What is the InChIKey of 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide?
The InChIKey is SBIJLJSTMLMOGN-RGXXVGJFSA-N. The full InChI is InChI=1S/C22H26FN7O.C22H24FN5O.C21H21F2N5O.C21H24FN7/c1-13-4-5-16(17(23)8-13)10-19-26-20(29-7-6-25-18(12-29)22(24)31)11-21(27-19)30-15(3)9-14(2)28-30;1-14-4-5-17(8-19(14)23)7-18-9-20(27-10-22(11-27)12-29-13-22)25-21(24-18)28-16(3)6-15(2)26-28;1-13-5-14(2)28(26-13)20-8-19(27-9-21(10-27)11-29-12-21)24-18(25-20)7-15-3-4-16(22)17(23)6-15;1-12-4-5-15(8-18(12)22)24-21-25-19(28-11-16-7-17(28)10-23-16)9-20(26-21)29-14(3)6-13(2)27-29/h4-5,8-9,11,18,25H,6-7,10,12H2,1-3H3,(H2,24,31);4-6,8-9H,7,10-13H2,1-3H3;3-6,8H,7,9-12H2,1-2H3;4-6,8-9,16-17,23H,7,10-11H2,1-3H3,(H,24,25,26)/t;;;16-,17-/m...1/s1.
What are the key properties of 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide?
4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide has a molecular weight of 1607.86 g/mol, XLogP of 10.74, 17 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-6-(3,5-dimethylpyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)pyrimidin-2-amine;6-[2-[(3,4-difluorophenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;6-[2-(3,5-dimethylpyrazol-1-yl)-6-[(3-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]-2-oxa-6-azaspiro[3.3]heptane;4-[6-(3,5-dimethylpyrazol-1-yl)-2-[(2-fluoro-4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-2-carboxamide is sourced from PubChem (CID 160786969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).