About 4-amino-3-cyclohexylthiophene-2-carboxamide
4-amino-3-cyclohexylthiophene-2-carboxamide (PubChem CID 174760123) has the molecular formula C11H16N2OS
and a molecular weight of 224.33 g/mol. Its IUPAC name is 4-amino-3-cyclohexylthiophene-2-carboxamide.
Molecular Properties
| Compound Name | 4-amino-3-cyclohexylthiophene-2-carboxamide |
| PubChem CID | 174760123 |
| Molecular Formula | C11H16N2OS |
| Molecular Weight | 224.33 g/mol |
| Exact Mass | 224.10 |
| IUPAC Name | 4-amino-3-cyclohexylthiophene-2-carboxamide |
| SMILES | NC(=O)c1scc(N)c1C1CCCCC1 |
| InChI | InChI=1S/C11H16N2OS/c12-8-6-15-10(11(13)14)9(8)7-4-2-1-3-5-7/h6-7H,1-5,12H2,(H2,13,14) |
| InChIKey | YPOXLVVIXWEZEW-UHFFFAOYSA-N |
| XLogP | 2.48 |
| TPSA | 69.11 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 224.33 |
| LogP ≤ 5 | 2.48 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-amino-3-cyclohexylthiophene-2-carboxamide?
The IUPAC name of 4-amino-3-cyclohexylthiophene-2-carboxamide (CID 174760123) is 4-amino-3-cyclohexylthiophene-2-carboxamide.
What is the SMILES notation for 4-amino-3-cyclohexylthiophene-2-carboxamide?
The canonical SMILES for 4-amino-3-cyclohexylthiophene-2-carboxamide is NC(=O)c1scc(N)c1C1CCCCC1.
What is the InChIKey of 4-amino-3-cyclohexylthiophene-2-carboxamide?
The InChIKey is YPOXLVVIXWEZEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c12-8-6-15-10(11(13)14)9(8)7-4-2-1-3-5-7/h6-7H,1-5,12H2,(H2,13,14).
What are the key properties of 4-amino-3-cyclohexylthiophene-2-carboxamide?
4-amino-3-cyclohexylthiophene-2-carboxamide has a molecular weight of 224.33 g/mol, XLogP of 2.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-cyclohexylthiophene-2-carboxamide is sourced from PubChem (CID 174760123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).