About 2,6-dimethyl-5-methylidene-4H-pyrimidine
2,6-dimethyl-5-methylidene-4H-pyrimidine (PubChem CID 91080340) has the molecular formula C7H10N2
and a molecular weight of 122.17 g/mol. Its IUPAC name is 2,6-dimethyl-5-methylidene-4H-pyrimidine.
Molecular Properties
| Compound Name | 2,6-dimethyl-5-methylidene-4H-pyrimidine |
|---|
| PubChem CID | 91080340 |
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| Molecular Formula | C7H10N2 |
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| Molecular Weight | 122.17 g/mol |
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| Exact Mass | 122.08 |
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| IUPAC Name | 2,6-dimethyl-5-methylidene-4H-pyrimidine |
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| SMILES | C=C1CN=C(C)N=C1C |
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| InChI | InChI=1S/C7H10N2/c1-5-4-8-7(3)9-6(5)2/h1,4H2,2-3H3 |
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| InChIKey | SVZIFAKPTIFJPX-UHFFFAOYSA-N |
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| XLogP | 1.44 |
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| TPSA | 24.72 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 2 |
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| Rotatable Bonds | |
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| Heavy Atoms | 9 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 122.17 |
| LogP ≤ 5 | 1.44 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2,6-dimethyl-5-methylidene-4H-pyrimidine?
The IUPAC name of 2,6-dimethyl-5-methylidene-4H-pyrimidine (CID 91080340) is 2,6-dimethyl-5-methylidene-4H-pyrimidine.
What is the SMILES notation for 2,6-dimethyl-5-methylidene-4H-pyrimidine?
The canonical SMILES for 2,6-dimethyl-5-methylidene-4H-pyrimidine is C=C1CN=C(C)N=C1C.
What is the InChIKey of 2,6-dimethyl-5-methylidene-4H-pyrimidine?
The InChIKey is SVZIFAKPTIFJPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-5-4-8-7(3)9-6(5)2/h1,4H2,2-3H3.
What are the key properties of 2,6-dimethyl-5-methylidene-4H-pyrimidine?
2,6-dimethyl-5-methylidene-4H-pyrimidine has a molecular weight of 122.17 g/mol, XLogP of 1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-5-methylidene-4H-pyrimidine is sourced from PubChem (CID 91080340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).