| CAS Number | 55656-99-0 |
| Catalog Number | AG00DEVU(AGN-PC-085FAM) |
| Chemical Name | 4-(3-Pyridinyl)-2-pyrrolidinone |
| IUPAC Name | 4-pyridin-3-ylpyrrolidin-2-one |
| InChI | InChI=1S/C9H10N2O/c12-9-4-8(6-11-9)7-2-1-3-10-5-7/h1-3,5,8H,4,6H2,(H,11,12) |
| InChI Key | MZFLMYXJIGUFBN-UHFFFAOYSA-N |
| MDL Number | MFCD16653126 |
| Molecular Formula | C9H10N2O |
| Molecular Weight | 162.1885 |
| SMILES | c1cc(cnc1)C2CC(=O)NC2 |
| Synonyms | 55656-99-0,
4-pyridin-3-ylpyrrolidin-2-one,
4-(3-PYRIDINYL)-2-PYRROLIDINONE,
4-(pyridin-3-yl)pyrrolidin-2-one,
4-(3-pyridyl)-2-pyrrolidone,
SCHEMBL8347624,
MFCD16653126,
2-Pyrrolidinone, 4-(3-pyridinyl)-,
AKOS006239567,
MCULE-6109188129,
AS-47415,
FT-0674204,
L-3908,
F2147-0764,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 162.192g/mol |
| Monoisotopic Mass | 162.079g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number