4-(Aminocarbonyl)-3-(cyclohexylamino)benzoic acid
Basic information
- Standard SMILES
NC(=O)c1ccc(C(=O)O)cc1NC1CCCCC1- InChIKey
ATIAAQGRDOGMSS-UHFFFAOYSA-N- Molecular formula
- C14H18N2O3
- Average molar mass
- 262.3 g/mol
Names & identifiers
- Preferred name
- 4-(Aminocarbonyl)-3-(cyclohexylamino)benzoic acid
- IUPAC
- 4-carbamoyl-3-(cyclohexylamino)benzoic acid
Names & synonyms
4-(aminocarbonyl)-3-(cyclohexylamino)benzoic acid1149385-58-9SCHEMBL2424448ATIAAQGRDOGMSS-UHFFFAOYSA-NDB-348742
Database identifiers
- PubChem CID
- 57748198
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
2 records
Compound notes
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