About (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one
(2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one (PubChem CID 161229105) has the molecular formula C43H53N7O2
and a molecular weight of 699.94 g/mol. Its IUPAC name is (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one.
Analyze (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one with MolForge
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Frequently Asked Questions
What is the IUPAC name of (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one?
The IUPAC name of (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one (CID 161229105) is (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one.
What is the SMILES notation for (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one?
The canonical SMILES for (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one is Cc1ccc2cc(-c3cnc([C@@H]4CCCN4C(=O)[C@H](C)c4ccccc4)[nH]3)ccc2c1.Cc1cnc(NC[C@@H]2CCCN2C(=O)[C@@H](C)C(C)C)nc1.
What is the InChIKey of (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one?
The InChIKey is UYNANHDPJPHOPH-WVPUHSCESA-N. The full InChI is InChI=1S/C27H27N3O.C16H26N4O/c1-18-10-11-22-16-23(13-12-21(22)15-18)24-17-28-26(29-24)25-9-6-14-30(25)27(31)19(2)20-7-4-3-5-8-20;1-11(2)13(4)15(21)20-7-5-6-14(20)10-19-16-17-8-12(3)9-18-16/h3-5,7-8,10-13,15-17,19,25H,6,9,14H2,1-2H3,(H,28,29);8-9,11,13-14H,5-7,10H2,1-4H3,(H,17,18,19)/t19-,25+;13-,14-/m10/s1.
What are the key properties of (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one?
(2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one has a molecular weight of 699.94 g/mol, XLogP of 8.49, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,3-dimethyl-1-[(2S)-2-[[(5-methylpyrimidin-2-yl)amino]methyl]pyrrolidin-1-yl]butan-1-one;(2R)-1-[(2S)-2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-phenylpropan-1-one is sourced from PubChem (CID 161229105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).