| CAS Number | 1018504-63-6 |
| Catalog Number | AG019MSH(AGN-PC-0WOCN8) |
| Chemical Name | 1-[(Propan-2-yl)carbamoyl]piperidine-4-carboxylic acid |
| IUPAC Name | 1-(propan-2-ylcarbamoyl)piperidine-4-carboxylic acid |
| InChI | InChI=1S/C10H18N2O3/c1-7(2)11-10(15)12-5-3-8(4-6-12)9(13)14/h7-8H,3-6H2,1-2H3,(H,11,15)(H,13,14) |
| InChI Key | NNVNEGUYUNQMTQ-UHFFFAOYSA-N |
| MDL Number | MFCD10012220 |
| Molecular Formula | C10H18N2O3 |
| Molecular Weight | 214.2615 |
| SMILES | CC(NC(N1CCC(C(O)=O)CC1)=O)C |
| Synonyms | 1-[(propan-2-yl)carbamoyl]piperidine-4-carboxylic acid,
1-[(isopropylamino)carbonyl]piperidine-4-carboxylic acid,
1018504-63-6,
AC1Q1Q7S,
SCHEMBL14355657,
CTK6B0043,
ZINC19982048,
AKOS009222801,
MCULE-6413060202,
NE61183,
EN300-37137,
Z381429022,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.265g/mol |
| Monoisotopic Mass | 214.132g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 69.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
Lot Number