4-[(3-Methylpyridin-2-yl)amino]-4-oxobutanoic acid
Basic information
- CAS
200417-51-2- Standard SMILES
Cc1cccnc1NC(=O)CCC(=O)O- InChIKey
GVZPPQAPLNIQBF-UHFFFAOYSA-N- Molecular formula
- C10H12N2O3
- Average molar mass
- 208.21 g/mol
- Monoisotopic mass
- 208.08479225
Names & identifiers
- Preferred name
- 4-[(3-Methylpyridin-2-yl)amino]-4-oxobutanoic acid
- IUPAC
- 4-[(3-methyl-2-pyridinyl)amino]-4-oxobutanoic acid
- English name
- 4-[(3-METHYLPYRIDIN-2-YL)AMINO]-4-OXOBUTANOIC ACID
- Molecular formula
- C10H12N2O3
- Molecular weight
- 208.21
Names & synonyms
200417-51-24-[(3-methylpyridin-2-yl)amino]-4-oxobutanoic acid4-((3-Methylpyridin-2-yl)amino)-4-oxobutanoic acidBAS 01375430N-(3-Methyl-pyridin-2-yl)-succinamic acidOprea1_275136Oprea1_741686SCHEMBL167881Butanoic acid, 4-[(3-methyl-2-pyridinyl)amino]-4-oxo-DTXSID70355630AKOS000300902CS-0336567
Show more names
ST500089363-[N-(3-methyl-2-pyridyl)carbamoyl]propanoic acid4-((3-Methylpyridin-2-yl)amino)-4-oxobutanoicacid4-[(3-methyl-2-pyridyl)amino]-4-oxo-butanoic acid
Database identifiers
- CAS
200417-51-2- PubChem CID
- 810222
- DTXSID
DTXSID70355630
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 79.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- Hazard Codes
- Xi,Xn
- Risk Statements
- 22 · 22
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- risk_code
- 22
- hazard_code
- Xi,Xn
- hazard_class
- IRRITANT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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