| CAS Number | 1209155-95-2 |
| Catalog Number | AG019XHX(AGN-PC-0WORMJ) |
| Chemical Name | 6-Methyl-2-(pyrrolidin-1-yl)pyridine-3-carbonitrile |
| IUPAC Name | 6-methyl-2-pyrrolidin-1-ylpyridine-3-carbonitrile |
| InChI | InChI=1S/C11H13N3/c1-9-4-5-10(8-12)11(13-9)14-6-2-3-7-14/h4-5H,2-3,6-7H2,1H3 |
| InChI Key | GABFCISJCPSYJX-UHFFFAOYSA-N |
| MDL Number | MFCD13196167 |
| Molecular Formula | C11H13N3 |
| Molecular Weight | 187.2410 |
| SMILES | CC1=NC(N2CCCC2)=C(C#N)C=C1 |
| Synonyms | 6-methyl-2-(pyrrolidin-1-yl)pyridine-3-carbonitrile,
1209155-95-2,
AC1Q2OZI,
SCHEMBL15831793,
CTK7C8272,
BBL035064,
SBB081835,
STL426099,
ZINC38342417,
AKOS004896969,
MCULE-1522342554,
NE18698,
6-methyl-2-(pyrrolidin-1-yl)nicotinonitrile,
EN300-55057,
6-methyl-2-pyrrolidinylpyridine-3-carbonitrile,
Z1258578315,
|
| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.246g/mol |
| Monoisotopic Mass | 187.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number