| CAS Number | 1284992-47-7 |
| Catalog Number | AG00J2EY(AGN-PC-0WB5VH) |
| Chemical Name | 2-((1-(tert-Butoxycarbonyl)piperidin-4-yl)(methyl)amino)acetic acid |
| IUPAC Name | 2-[methyl-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]amino]acetic acid |
| InChI | InChI=1S/C13H24N2O4/c1-13(2,3)19-12(18)15-7-5-10(6-8-15)14(4)9-11(16)17/h10H,5-9H2,1-4H3,(H,16,17) |
| InChI Key | TWFKYFSKUWRGMN-UHFFFAOYSA-N |
| MDL Number | MFCD11520516 |
| Molecular Formula | C13H24N2O4 |
| Molecular Weight | 272.3407 |
| SMILES | C(C)(C)(C)OC(=O)N1CCC(CC1)N(CC(=O)O)C |
| Synonyms | 1284992-47-7,
N-[1-(tert-Butoxycarbonyl)-4-piperidinyl]-N-methylglycine,
2-((1-(tert-Butoxycarbonyl)piperidin-4-yl)(methyl)amino)acetic acid,
SCHEMBL16105020,
ZX-CM009356,
ZINC49584982,
AKOS016346999,
Y-7694,
AJ-111224,
|
| Complexity | 330 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.173607g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.34g/mol |
| Monoisotopic Mass | 272.173607g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 70.1Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1 |
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Certificate of Analysis
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