CID 45084411
Basic information
- CAS
170312-36-4- Standard SMILES
C[C@@H]1C(=O)CCC[C@H]1C(N)=O- InChIKey
CNQXKXFIVYVEQO-NTSWFWBYSA-N- Molecular formula
- C8H13NO2
- Average molar mass
- 155.19 g/mol
Names & identifiers
- Preferred name
- CID 45084411
- IUPAC
- cis-(1R,2S)-2-methyl-3-oxocyclohexane-1-carboxamide
- English name
- Cyclohexanecarboxamide, 2-methyl-3-oxo-, trans- (9CI)
- Molecular formula
- C8H13NO2
- Molecular weight
- 155.19
Names & synonyms
Cyclohexanecarboxamide, 2-methyl-3-oxo-, trans- (9CI)
Database identifiers
- CAS
170312-36-4
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 189
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Compound notes
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