About N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine
N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine (PubChem CID 131110420) has the molecular formula C10H15N3
and a molecular weight of 177.25 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine.
Molecular Properties
| Compound Name | N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine |
| PubChem CID | 131110420 |
| Molecular Formula | C10H15N3 |
| Molecular Weight | 177.25 g/mol |
| Exact Mass | 177.13 |
| IUPAC Name | N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine |
| SMILES | CCN(c1ncc(C)cn1)C1CC1 |
| InChI | InChI=1S/C10H15N3/c1-3-13(9-4-5-9)10-11-6-8(2)7-12-10/h6-7,9H,3-5H2,1-2H3 |
| InChIKey | OGKMHAGASZSYGV-UHFFFAOYSA-N |
| XLogP | 1.77 |
| TPSA | 29.02 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 177.25 |
| LogP ≤ 5 | 1.77 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine?
The IUPAC name of N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine (CID 131110420) is N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine.
What is the SMILES notation for N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine?
The canonical SMILES for N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine is CCN(c1ncc(C)cn1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine?
The InChIKey is OGKMHAGASZSYGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-3-13(9-4-5-9)10-11-6-8(2)7-12-10/h6-7,9H,3-5H2,1-2H3.
What are the key properties of N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine?
N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine has a molecular weight of 177.25 g/mol, XLogP of 1.77, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-5-methylpyrimidin-2-amine is sourced from PubChem (CID 131110420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).