About 2-amino-1,2-dihydroimidazol-5-one
2-amino-1,2-dihydroimidazol-5-one (PubChem CID 18667660) has the molecular formula C3H5N3O
and a molecular weight of 99.09 g/mol. Its IUPAC name is 2-amino-1,2-dihydroimidazol-5-one.
Molecular Properties
| Compound Name | 2-amino-1,2-dihydroimidazol-5-one |
|---|
| PubChem CID | 18667660 |
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| Molecular Formula | C3H5N3O |
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| Molecular Weight | 99.09 g/mol |
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| Exact Mass | 99.04 |
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| IUPAC Name | 2-amino-1,2-dihydroimidazol-5-one |
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| SMILES | NC1N=CC(=O)N1 |
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| InChI | InChI=1S/C3H5N3O/c4-3-5-1-2(7)6-3/h1,3H,4H2,(H,6,7) |
|---|
| InChIKey | UQLHWVHOFXABHP-UHFFFAOYSA-N |
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| XLogP | -1.57 |
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| TPSA | 67.48 Ų |
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| H-Bond Donors | 2 |
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| H-Bond Acceptors | 3 |
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| Rotatable Bonds | |
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| Heavy Atoms | 7 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 99.09 |
| LogP ≤ 5 | -1.57 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-amino-1,2-dihydroimidazol-5-one?
The IUPAC name of 2-amino-1,2-dihydroimidazol-5-one (CID 18667660) is 2-amino-1,2-dihydroimidazol-5-one.
What is the SMILES notation for 2-amino-1,2-dihydroimidazol-5-one?
The canonical SMILES for 2-amino-1,2-dihydroimidazol-5-one is NC1N=CC(=O)N1.
What is the InChIKey of 2-amino-1,2-dihydroimidazol-5-one?
The InChIKey is UQLHWVHOFXABHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5N3O/c4-3-5-1-2(7)6-3/h1,3H,4H2,(H,6,7).
What are the key properties of 2-amino-1,2-dihydroimidazol-5-one?
2-amino-1,2-dihydroimidazol-5-one has a molecular weight of 99.09 g/mol, XLogP of -1.57, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1,2-dihydroimidazol-5-one is sourced from PubChem (CID 18667660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).