| CAS Number | 767263-33-2 |
| Catalog Number | AG005VJQ(AGN-PC-09RDRT) |
| Chemical Name | 4-PIPERIDINECARBONITRILE, 4-(2-PYRIDINYL)- |
| IUPAC Name | 4-pyridin-2-ylpiperidine-4-carbonitrile |
| InChI | InChI=1S/C11H13N3/c12-9-11(4-7-13-8-5-11)10-3-1-2-6-14-10/h1-3,6,13H,4-5,7-8H2 |
| InChI Key | VXQVGWZSCZUOKK-UHFFFAOYSA-N |
| MDL Number | MFCD18071627 |
| Molecular Formula | C11H13N3 |
| Molecular Weight | 187.2410 |
| SMILES | N#CC1(C2=NC=CC=C2)CCNCC1 |
| Synonyms | 4-(Pyridin-2-yl)piperidine-4-carbonitrile,
767263-33-2,
4-PIPERIDINECARBONITRILE, 4-(2-PYRIDINYL)-,
SCHEMBL761352,
CTK5E3348,
DTXSID40693637,
VXQVGWZSCZUOKK-UHFFFAOYSA-N,
ZINC82879725,
AKOS017515401,
4-pyridin-2-ylpiperidine4-carbonitrile,
4-(2-Pyridyl)piperidine-4-carbonitrile,
4-pyridin-2-ylpiperidine-4-carbonitrile,
SC-68065,
AJ-125679,
Z1993522728,
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| Complexity | 234 |
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.246g/mol |
| Monoisotopic Mass | 187.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
Lot Number