2-(3-((tert-Butoxycarbonyl)amino)piperidin-1-yl)acetic acid
Basic information
- CAS
1353972-52-7- Standard SMILES
CC(C)(C)OC(=O)NC1CCCN(CC(=O)O)C1- InChIKey
XLJZVODYVORIOT-UHFFFAOYSA-N- Molecular formula
- C12H22N2O4
- Average molar mass
- 258.31 g/mol
- Monoisotopic mass
- 258.15795719
Names & identifiers
- Preferred name
- 2-(3-((tert-Butoxycarbonyl)amino)piperidin-1-yl)acetic acid
- IUPAC
- 2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]acetic acid
- English name
- (3-tert-ButoxycarbonylaMino-piperidin-1-yl)-acetic acid
- Molecular formula
- C12H22N2O4
- Molecular weight
- 258.31
Names & synonyms
1353972-52-72-(3-((tert-Butoxycarbonyl)amino)piperidin-1-yl)acetic acid(3-tert-Butoxycarbonylamino-piperidin-1-yl)-acetic acid2-[3-(tert-butoxycarbonylamino)-1-piperidyl]acetic acid2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]acetic acidSCHEMBL26090632DTXSID701169717MFCD21094954AKOS023757377SB43955DB-247050CS-0445217
Show more names
EN300-6993652(3-tert-Butoxycarbonylamino-piperidin-1-yl)acetic acid2-(3-((tert-Butoxycarbonyl)amino)piperidin-1-yl)aceticacid2-(3-{[(tert-butoxy)carbonyl]amino}piperidin-1-yl)acetic acid{3-[(TERT-BUTOXYCARBONYL)AMINO]PIPERIDIN-1-YL}ACETIC ACID1-Piperidineacetic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-
Database identifiers
- CAS
1353972-52-7- PubChem CID
- 66566397
- DTXSID
DTXSID701169717
Properties
Computed structural properties
- XLogP
- -1.2
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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