| CAS Number | 89532-48-9 |
| Catalog Number | AG00IFRC |
| Chemical Name | 1H-Pyrrole-2-acetamide |
| IUPAC Name | 2-(1H-pyrrol-2-yl)acetamide |
| InChI | InChI=1S/C6H8N2O/c7-6(9)4-5-2-1-3-8-5/h1-3,8H,4H2,(H2,7,9) |
| InChI Key | NHNHWBFFDARHFO-UHFFFAOYSA-N |
| MDL Number | MFCD15832990 |
| Molecular Formula | C6H8N2O |
| Molecular Weight | 124.1405 |
| SMILES | NC(CC1NC=CC=1)=O |
| Synonyms | 1H-PYRROLE-2-ACETAMIDE,
2-(1H-pyrrol-2-yl)acetamide,
89532-48-9,
pyrroleacetamide,
SCHEMBL9978846,
ZINC34405481,
AKOS006338191,
AM806500,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 124.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 124.143g/mol |
| Monoisotopic Mass | 124.064g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
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