About formamide;formic acid
formamide;formic acid (PubChem CID 22670458) has the molecular formula C2H5NO3
and a molecular weight of 91.07 g/mol. Its IUPAC name is formamide;formic acid.
Molecular Properties
| Compound Name | formamide;formic acid |
|---|
| PubChem CID | 22670458 |
|---|
| Molecular Formula | C2H5NO3 |
|---|
| Molecular Weight | 91.07 g/mol |
|---|
| Exact Mass | 91.03 |
|---|
| IUPAC Name | formamide;formic acid |
|---|
| SMILES | NC=O.O=CO |
|---|
| InChI | InChI=1S/CH3NO.CH2O2/c2*2-1-3/h1H,(H2,2,3);1H,(H,2,3) |
|---|
| InChIKey | QVAWPEGWRUXBQH-UHFFFAOYSA-N |
|---|
| XLogP | -1.20 |
|---|
| TPSA | 80.39 Ų |
|---|
| H-Bond Donors | 2 |
|---|
| H-Bond Acceptors | 2 |
|---|
| Rotatable Bonds | |
|---|
| Heavy Atoms | 6 |
|---|
| Complexity | — |
|---|
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 91.07 |
| LogP ≤ 5 | -1.20 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'} |
|---|
Analyze formamide;formic acid with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of formamide;formic acid?
The IUPAC name of formamide;formic acid (CID 22670458) is formamide;formic acid.
What is the SMILES notation for formamide;formic acid?
The canonical SMILES for formamide;formic acid is NC=O.O=CO.
What is the InChIKey of formamide;formic acid?
The InChIKey is QVAWPEGWRUXBQH-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3NO.CH2O2/c2*2-1-3/h1H,(H2,2,3);1H,(H,2,3).
What are the key properties of formamide;formic acid?
formamide;formic acid has a molecular weight of 91.07 g/mol, XLogP of -1.20, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formamide;formic acid is sourced from PubChem (CID 22670458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).