About N-cyclopropyl-N-(1-hydroxyethyl)formamide
N-cyclopropyl-N-(1-hydroxyethyl)formamide (PubChem CID 174552512) has the molecular formula C6H11NO2
and a molecular weight of 129.16 g/mol. Its IUPAC name is N-cyclopropyl-N-(1-hydroxyethyl)formamide.
Molecular Properties
| Compound Name | N-cyclopropyl-N-(1-hydroxyethyl)formamide |
| PubChem CID | 174552512 |
| Molecular Formula | C6H11NO2 |
| Molecular Weight | 129.16 g/mol |
| Exact Mass | 129.08 |
| IUPAC Name | N-cyclopropyl-N-(1-hydroxyethyl)formamide |
| SMILES | CC(O)N(C=O)C1CC1 |
| InChI | InChI=1S/C6H11NO2/c1-5(9)7(4-8)6-2-3-6/h4-6,9H,2-3H2,1H3 |
| InChIKey | AGMIXKRWHAPNAN-UHFFFAOYSA-N |
| XLogP | -0.05 |
| TPSA | 40.54 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 129.16 |
| LogP ≤ 5 | -0.05 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopropyl-N-(1-hydroxyethyl)formamide?
The IUPAC name of N-cyclopropyl-N-(1-hydroxyethyl)formamide (CID 174552512) is N-cyclopropyl-N-(1-hydroxyethyl)formamide.
What is the SMILES notation for N-cyclopropyl-N-(1-hydroxyethyl)formamide?
The canonical SMILES for N-cyclopropyl-N-(1-hydroxyethyl)formamide is CC(O)N(C=O)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(1-hydroxyethyl)formamide?
The InChIKey is AGMIXKRWHAPNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-5(9)7(4-8)6-2-3-6/h4-6,9H,2-3H2,1H3.
What are the key properties of N-cyclopropyl-N-(1-hydroxyethyl)formamide?
N-cyclopropyl-N-(1-hydroxyethyl)formamide has a molecular weight of 129.16 g/mol, XLogP of -0.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(1-hydroxyethyl)formamide is sourced from PubChem (CID 174552512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).