| CAS Number | 923177-00-8 |
| Catalog Number | AG00IVU7(AGN-PC-0WB2P5) |
| Chemical Name | 1-(Ethylcarbamoyl)piperidine-4-carboxylic acid |
| IUPAC Name | 1-(ethylcarbamoyl)piperidine-4-carboxylic acid |
| InChI | InChI=1S/C9H16N2O3/c1-2-10-9(14)11-5-3-7(4-6-11)8(12)13/h7H,2-6H2,1H3,(H,10,14)(H,12,13) |
| InChI Key | ZOZZOPAKYBZJKZ-UHFFFAOYSA-N |
| MDL Number | MFCD08444848 |
| Molecular Formula | C9H16N2O3 |
| Molecular Weight | 200.2349 |
| SMILES | CCNC(N1CCC(C(O)=O)CC1)=O |
| Synonyms | 1-(Ethylcarbamoyl)piperidine-4-carboxylic acid,
923177-00-8,
1-[(ethylamino)carbonyl]piperidine-4-carboxylic acid,
AC1Q31CE,
SCHEMBL12955182,
CTK6F2048,
KS-00002B6M,
ethylcarbamoylpiperidinecarboxylicacid,
MFCD08444848,
ZINC20284562,
AKOS009113468,
MCULE-6804249333,
RP11713,
SS-4318,
TR-071675,
EN300-86738,
F8889-5279,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.238g/mol |
| Monoisotopic Mass | 200.116g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 69.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number