About N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide
N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide (PubChem CID 155930178) has the molecular formula C11H19NO
and a molecular weight of 181.28 g/mol. Its IUPAC name is N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide.
Molecular Properties
| Compound Name | N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide |
| PubChem CID | 155930178 |
| Molecular Formula | C11H19NO |
| Molecular Weight | 181.28 g/mol |
| Exact Mass | 181.15 |
| IUPAC Name | N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide |
| SMILES | C/C=C/N(C)C(=O)C1CCCCC1 |
| InChI | InChI=1S/C11H19NO/c1-3-9-12(2)11(13)10-7-5-4-6-8-10/h3,9-10H,4-8H2,1-2H3/b9-3+ |
| InChIKey | VFUMHIZOKJHVSU-YCRREMRBSA-N |
| XLogP | 2.56 |
| TPSA | 20.31 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 181.28 |
| LogP ≤ 5 | 2.56 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide?
The IUPAC name of N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide (CID 155930178) is N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide.
What is the SMILES notation for N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide?
The canonical SMILES for N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide is C/C=C/N(C)C(=O)C1CCCCC1.
What is the InChIKey of N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide?
The InChIKey is VFUMHIZOKJHVSU-YCRREMRBSA-N. The full InChI is InChI=1S/C11H19NO/c1-3-9-12(2)11(13)10-7-5-4-6-8-10/h3,9-10H,4-8H2,1-2H3/b9-3+.
What are the key properties of N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide?
N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide has a molecular weight of 181.28 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide is sourced from PubChem (CID 155930178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).