1-(Furan-2-carboxamido)cyclohexanecarboxylic acid
Basic information
- CAS
63203-41-8- Standard SMILES
O=C(NC1(C(=O)O)CCCCC1)c1ccco1- InChIKey
VRWUFITYIPKVFL-UHFFFAOYSA-N- Molecular formula
- C12H15NO4
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.10010796
Names & identifiers
- Preferred name
- 1-(Furan-2-carboxamido)cyclohexanecarboxylic acid
- IUPAC
- 1-(furan-2-carbonylamino)cyclohexane-1-carboxylic acid
Names & synonyms
63203-41-81-(Furan-2-carboxamido)cyclohexanecarboxylic acid1-[(2-Furanylcarbonyl)amino]cyclohexanecarboxylic acidSCHEMBL1843420DTXSID00589628VRWUFITYIPKVFL-UHFFFAOYSA-NAKOS000193474DB-1320911-(Furan-2-carboxamido)cyclohexane-1-carboxylic acidZ858881131-[(Furan-2-carbonyl)amino]cyclohexane-1-carboxylic acid1-[N-(furan-2-ylcarbonyl)amino]cyclohexanecarboxylic acid
Database identifiers
- CAS
63203-41-8- PubChem CID
- 17455254
- DTXSID
DTXSID00589628- Nikkaji
- J3.278.581F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 310
Related reactions
14 records
Compound notes
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