About 6-chloro-2-cyclopropylquinazolin-4-amine
6-chloro-2-cyclopropylquinazolin-4-amine (PubChem CID 106583780) has the molecular formula C11H10ClN3
and a molecular weight of 219.68 g/mol. Its IUPAC name is 6-chloro-2-cyclopropylquinazolin-4-amine.
Molecular Properties
| Compound Name | 6-chloro-2-cyclopropylquinazolin-4-amine |
| PubChem CID | 106583780 |
| Molecular Formula | C11H10ClN3 |
| Molecular Weight | 219.68 g/mol |
| Exact Mass | 219.06 |
| IUPAC Name | 6-chloro-2-cyclopropylquinazolin-4-amine |
| SMILES | Nc1nc(C2CC2)nc2ccc(Cl)cc12 |
| InChI | InChI=1S/C11H10ClN3/c12-7-3-4-9-8(5-7)10(13)15-11(14-9)6-1-2-6/h3-6H,1-2H2,(H2,13,14,15) |
| InChIKey | NOHCKUHZVIKUEE-UHFFFAOYSA-N |
| XLogP | 2.74 |
| TPSA | 51.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 219.68 |
| LogP ≤ 5 | 2.74 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-chloro-2-cyclopropylquinazolin-4-amine?
The IUPAC name of 6-chloro-2-cyclopropylquinazolin-4-amine (CID 106583780) is 6-chloro-2-cyclopropylquinazolin-4-amine.
What is the SMILES notation for 6-chloro-2-cyclopropylquinazolin-4-amine?
The canonical SMILES for 6-chloro-2-cyclopropylquinazolin-4-amine is Nc1nc(C2CC2)nc2ccc(Cl)cc12.
What is the InChIKey of 6-chloro-2-cyclopropylquinazolin-4-amine?
The InChIKey is NOHCKUHZVIKUEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3/c12-7-3-4-9-8(5-7)10(13)15-11(14-9)6-1-2-6/h3-6H,1-2H2,(H2,13,14,15).
What are the key properties of 6-chloro-2-cyclopropylquinazolin-4-amine?
6-chloro-2-cyclopropylquinazolin-4-amine has a molecular weight of 219.68 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-cyclopropylquinazolin-4-amine is sourced from PubChem (CID 106583780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).