| CAS Number | 852851-85-5 |
| Catalog Number | AG00IDMD(AGN-PC-0WOA7D) |
| Chemical Name | 4-Chloro-2-(piperidine-1-carbonyl)pyridine |
| IUPAC Name | (4-chloropyridin-2-yl)-piperidin-1-ylmethanone |
| InChI | InChI=1S/C11H13ClN2O/c12-9-4-5-13-10(8-9)11(15)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2 |
| InChI Key | CXAYZALESVPCFR-UHFFFAOYSA-N |
| MDL Number | MFCD06655679 |
| Molecular Formula | C11H13ClN2O |
| Molecular Weight | 224.6867 |
| SMILES | ClC1=CC(=NC=C1)C(=O)N1CCCCC1 |
| Synonyms | 4-chloro-2-(piperidin-1-ylcarbonyl)pyridine,
852851-85-5,
4-chloro-2-(piperidine-1-carbonyl)pyridine,
AC1NLQCL,
AC1Q3I1Z,
SCHEMBL1507205,
CTK7G0534,
ZINC4206212,
MFCD06655679,
AKOS008999024,
NE59688,
EN300-13130,
4-chloro-2-[(piperidin-1-yl)carbonyl]pyridine,
(4-chloropyridin-2-yl)-piperidin-1-ylmethanone,
SR-01000068481,
4-CHLORO-2-(1-PIPERIDINYLCARBONYL)PYRIDINE,
SR-01000068481-1,
ZINC04206212,
CID4962251,
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| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.688g/mol |
| Monoisotopic Mass | 224.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
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