Glycine, N-(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)-
Basic information
- CAS
882-07-5- Standard SMILES
CC1(C)CC(=O)C=C(NCC(=O)O)C1- InChIKey
MKILHWOJDFVJNQ-UHFFFAOYSA-N- Molecular formula
- C10H15NO3
- Average molar mass
- 197.23 g/mol
- Monoisotopic mass
- 197.10519334
Names & identifiers
- Preferred name
- Glycine, N-(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)-
- IUPAC
- 2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]acetic acid
Names & synonyms
882-07-52-((5,5-dimethyl-3-oxocyclohex-1-en-1-yl)amino)acetic acid(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)glycineZINC100672069Glycine, N-(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)-SMR000060884Oprea1_190230MLS000054516cid_676799IFLab1_001302CHEMBL1709969SCHEMBL24880296
Show more names
BDBM56276DTXSID80388196HMS1415L04HMS2503B13MFCD00807604STK024385AKOS001032742IDI1_009169
Database identifiers
- CAS
882-07-5- PubChem CID
- 2999403
- DTXSID
DTXSID80388196- ChEMBL
CHEMBL1709969- Nikkaji
- J2.351.976C
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 292
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Related reactions
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Compound notes
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