About (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol
(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol (PubChem CID 103922625) has the molecular formula C10H17N3O
and a molecular weight of 195.27 g/mol. Its IUPAC name is (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol.
Molecular Properties
| Compound Name | (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol |
| PubChem CID | 103922625 |
| Molecular Formula | C10H17N3O |
| Molecular Weight | 195.27 g/mol |
| Exact Mass | 195.14 |
| IUPAC Name | (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol |
| SMILES | CC[C@H](CO)NC(C)c1cnccn1 |
| InChI | InChI=1S/C10H17N3O/c1-3-9(7-14)13-8(2)10-6-11-4-5-12-10/h4-6,8-9,13-14H,3,7H2,1-2H3/t8?,9-/m1/s1 |
| InChIKey | BFTSLGNCUIKFNF-YGPZHTELSA-N |
| XLogP | 0.90 |
| TPSA | 58.04 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 195.27 |
| LogP ≤ 5 | 0.90 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol?
The IUPAC name of (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol (CID 103922625) is (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol.
What is the SMILES notation for (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol?
The canonical SMILES for (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol is CC[C@H](CO)NC(C)c1cnccn1.
What is the InChIKey of (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol?
The InChIKey is BFTSLGNCUIKFNF-YGPZHTELSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-9(7-14)13-8(2)10-6-11-4-5-12-10/h4-6,8-9,13-14H,3,7H2,1-2H3/t8?,9-/m1/s1.
What are the key properties of (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol?
(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol has a molecular weight of 195.27 g/mol, XLogP of 0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol is sourced from PubChem (CID 103922625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).