About (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine
(3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine (PubChem CID 118720880) has the molecular formula C19H19N5O
and a molecular weight of 333.39 g/mol. Its IUPAC name is (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine.
Molecular Properties
| Compound Name | (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine |
| PubChem CID | 118720880 |
| Molecular Formula | C19H19N5O |
| Molecular Weight | 333.39 g/mol |
| Exact Mass | 333.16 |
| IUPAC Name | (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine |
| SMILES | C[C@@H]1COCCN1c1nc(-c2cccc3[nH]ccc23)cc2nccn12 |
| InChI | InChI=1S/C19H19N5O/c1-13-12-25-10-9-23(13)19-22-17(11-18-21-7-8-24(18)19)14-3-2-4-16-15(14)5-6-20-16/h2-8,11,13,20H,9-10,12H2,1H3/t13-/m1/s1 |
| InChIKey | MEPMUNLPHFTRNW-CYBMUJFWSA-N |
| XLogP | 3.10 |
| TPSA | 58.45 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 333.39 |
| LogP ≤ 5 | 3.10 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine?
The IUPAC name of (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine (CID 118720880) is (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine.
What is the SMILES notation for (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine?
The canonical SMILES for (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine is C[C@@H]1COCCN1c1nc(-c2cccc3[nH]ccc23)cc2nccn12.
What is the InChIKey of (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine?
The InChIKey is MEPMUNLPHFTRNW-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H19N5O/c1-13-12-25-10-9-23(13)19-22-17(11-18-21-7-8-24(18)19)14-3-2-4-16-15(14)5-6-20-16/h2-8,11,13,20H,9-10,12H2,1H3/t13-/m1/s1.
What are the key properties of (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine?
(3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine has a molecular weight of 333.39 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-4-[7-(1H-indol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]-3-methylmorpholine is sourced from PubChem (CID 118720880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).