About 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine (PubChem CID 158606758) has the molecular formula C158H229N41O19
and a molecular weight of 3006.84 g/mol. Its IUPAC name is 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine.
Frequently Asked Questions
What is the IUPAC name of 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine?
The IUPAC name of 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine (CID 158606758) is 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine.
What is the SMILES notation for 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine?
The canonical SMILES for 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine is CNc1cc(C)nc(Nc2ccc(OC)c(CCCCN3CCCC3)c2)n1.CNc1cc(C)nc(Nc2ccc(OC)c(OCC(O)CN3CCCC3)c2)n1.CNc1cc(C)nc(Nc2ccc(OC)c(OC[C@@H](O)CN3CCCC3)c2)n1.CNc1cc(C)nc(Nc2ccc(OC)c(OC[C@H](O)CN3CCCC3)c2)n1.CNc1cc(C)nc(Nc2cnc(OC)c(OCC3CCN(C)C3)c2)n1.CNc1cc(C)nc(Nc2cnc(OC)c(OC[C@@H]3CCN(C)C3)c2)n1.CNc1cc(C)nc(Nc2cnc(OC)c(OC[C@H]3CCN(C)C3)c2)n1.CNc1cc(C2CCOCC2)c2cc(OC)c(OCCCN3CCCC3)cc2n1.
What is the InChIKey of 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine?
The InChIKey is HWHZVMSQPMCSMV-UAKVTQNSSA-N. The full InChI is InChI=1S/C23H33N3O3.C21H31N5O.3C20H29N5O3.3C18H26N6O2/c1-24-23-15-18(17-6-12-28-13-7-17)19-14-21(27-2)22(16-20(19)25-23)29-11-5-10-26-8-3-4-9-26;1-16-14-20(22-2)25-21(23-16)24-18-9-10-19(27-3)17(15-18)8-4-5-11-26-12-6-7-13-26;3*1-14-10-19(21-2)24-20(22-14)23-15-6-7-17(27-3)18(11-15)28-13-16(26)12-25-8-4-5-9-25;3*1-12-7-16(19-2)23-18(21-12)22-14-8-15(17(25-4)20-9-14)26-11-13-5-6-24(3)10-13/h14-17H,3-13H2,1-2H3,(H,24,25);9-10,14-15H,4-8,11-13H2,1-3H3,(H2,22,23,24,25);3*6-7,10-11,16,26H,4-5,8-9,12-13H2,1-3H3,(H2,21,22,23,24);3*7-9,13H,5-6,10-11H2,1-4H3,(H2,19,21,22,23)/t;;2*16-;;2*13-;/m..10.10./s1.
What are the key properties of 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine?
1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine has a molecular weight of 3006.84 g/mol, XLogP of 22.20, 65 rotatable bonds, 18 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2S)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;(2R)-1-[2-methoxy-5-[[4-methyl-6-(methylamino)pyrimidin-2-yl]amino]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol;6-methoxy-N-methyl-4-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine;2-N-[6-methoxy-5-[(1-methylpyrrolidin-3-yl)methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[6-methoxy-5-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-3-pyridinyl]-4-N,6-dimethylpyrimidine-2,4-diamine;2-N-[4-methoxy-3-(4-pyrrolidin-1-ylbutyl)phenyl]-4-N,6-dimethylpyrimidine-2,4-diamine is sourced from PubChem (CID 158606758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).