About N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine
N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine (PubChem CID 158249241) has the molecular formula C108H130F15N19O2S
and a molecular weight of 2043.40 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine.
Frequently Asked Questions
What is the IUPAC name of N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine (CID 158249241) is N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine is CC(F)(F)c1ccc(C2CCCN2c2ncnc(NCC3CCC3)c2F)cc1.CC(F)(F)c1ccc(C2CCCN2c2ncnc(NCC3CCCCO3)c2F)cc1.CC(F)(F)c1ccc(C2CCCN2c2ncnc(NCC3CCCS3)c2F)cc1.CC(F)(F)c1ccc(C2CCCN2c2ncnc(NCC3CCOC3)c2F)cc1.CC1(CCc2ncnc(N3CCCC3c3ccc(C(C)(F)F)cc3)c2F)CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is GGMWRVFCCBRRRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28F3N3.C22H27F3N4O.C21H25F3N4O.C21H25F3N4S.C21H25F3N4/c1-22(11-4-12-22)13-10-18-20(24)21(28-15-27-18)29-14-3-5-19(29)16-6-8-17(9-7-16)23(2,25)26;1-22(24,25)16-9-7-15(8-10-16)18-6-4-11-29(18)21-19(23)20(27-14-28-21)26-13-17-5-2-3-12-30-17;1-21(23,24)16-6-4-15(5-7-16)17-3-2-9-28(17)20-18(22)19(26-13-27-20)25-11-14-8-10-29-12-14;1-21(23,24)15-8-6-14(7-9-15)17-5-2-10-28(17)20-18(22)19(26-13-27-20)25-12-16-4-3-11-29-16;1-21(23,24)16-9-7-15(8-10-16)17-6-3-11-28(17)20-18(22)19(26-13-27-20)25-12-14-4-2-5-14/h6-9,15,19H,3-5,10-14H2,1-2H3;7-10,14,17-18H,2-6,11-13H2,1H3,(H,26,27,28);4-7,13-14,17H,2-3,8-12H2,1H3,(H,25,26,27);6-9,13,16-17H,2-5,10-12H2,1H3,(H,25,26,27);7-10,13-14,17H,2-6,11-12H2,1H3,(H,25,26,27).
What are the key properties of N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine?
N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 2043.40 g/mol, XLogP of 26.42, 30 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-amine;4-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-6-[2-(1-methylcyclobutyl)ethyl]pyrimidine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxan-2-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(oxolan-3-ylmethyl)pyrimidin-4-amine;6-[2-[4-(1,1-difluoroethyl)phenyl]pyrrolidin-1-yl]-5-fluoro-N-(thiolan-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 158249241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).