About 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide
2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide (PubChem CID 63911495) has the molecular formula C11H21N3O2
and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide.
Molecular Properties
| Compound Name | 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide |
| PubChem CID | 63911495 |
| Molecular Formula | C11H21N3O2 |
| Molecular Weight | 227.31 g/mol |
| Exact Mass | 227.16 |
| IUPAC Name | 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide |
| SMILES | CC1COCCN1CC(N)(C(N)=O)C1CC1 |
| InChI | InChI=1S/C11H21N3O2/c1-8-6-16-5-4-14(8)7-11(13,10(12)15)9-2-3-9/h8-9H,2-7,13H2,1H3,(H2,12,15) |
| InChIKey | XTNBIQNRIDXRSN-UHFFFAOYSA-N |
| XLogP | -0.70 |
| TPSA | 81.58 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.31 |
| LogP ≤ 5 | -0.70 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide (CID 63911495) is 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide is CC1COCCN1CC(N)(C(N)=O)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide?
The InChIKey is XTNBIQNRIDXRSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8-6-16-5-4-14(8)7-11(13,10(12)15)9-2-3-9/h8-9H,2-7,13H2,1H3,(H2,12,15).
What are the key properties of 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide?
2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide has a molecular weight of 227.31 g/mol, XLogP of -0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-(3-methylmorpholin-4-yl)propanamide is sourced from PubChem (CID 63911495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).