About 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one
3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one (PubChem CID 158690817) has the molecular formula C72H96N18O12
and a molecular weight of 1405.67 g/mol. Its IUPAC name is 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one.
Frequently Asked Questions
What is the IUPAC name of 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one?
The IUPAC name of 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one (CID 158690817) is 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one.
What is the SMILES notation for 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one?
The canonical SMILES for 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one is CNc1cc(Nc2cccn(C3CCCOC3)c2=O)nc2c(C(=O)CCC(C)(C)CO)cnn12.CNc1cc(Nc2cccn([C@@H]3CCCOC3)c2=O)nc2c(C(=O)CCC(C)(C)CO)cnn12.CNc1cc(Nc2cccn([C@H]3CCCOC3)c2=O)nc2c(C(=O)CCC(C)(C)CO)cnn12.
What is the InChIKey of 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one?
The InChIKey is IGICKHZIJLLBGL-CQYLEEIWSA-N. The full InChI is InChI=1S/3C24H32N6O4/c3*1-24(2,15-31)9-8-19(32)17-13-26-30-21(25-3)12-20(28-22(17)30)27-18-7-4-10-29(23(18)33)16-6-5-11-34-14-16/h3*4,7,10,12-13,16,25,31H,5-6,8-9,11,14-15H2,1-3H3,(H,27,28)/t2*16-;/m10./s1.
What are the key properties of 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one?
3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one has a molecular weight of 1405.67 g/mol, XLogP of 9.03, 27 rotatable bonds, 9 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(oxan-3-yl)pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3S)-oxan-3-yl]pyridin-2-one;3-[[3-(5-hydroxy-4,4-dimethylpentanoyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-[(3R)-oxan-3-yl]pyridin-2-one is sourced from PubChem (CID 158690817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).