2-Cyclohexyl-2-ethyl-3,4-dihydro-2H-pyrrol-5-ol

HCID 201515

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Basic information

CAS: 6139-32-8
Standard SMILES: CCC1(C2CCCCC2)CCC(=O)N1
InChIKey: DDQRLPNIUKEIRP-UHFFFAOYSA-N
Molecular formula: C12H21NO
Average molar mass: 195.3 g/mol
Monoisotopic mass: 195.16231429

Names & identifiers

Preferred name: 2-Cyclohexyl-2-ethyl-3,4-dihydro-2H-pyrrol-5-ol
IUPAC: 5-cyclohexyl-5-ethylpyrrolidin-2-one

Names & synonyms

6139-32-8DTXSID709769402-Cyclohexyl-2-ethyl-3,4-dihydro-2H-pyrrol-5-olRefChem:1062929DTXCID2014043065-Cyclohexyl-5-ethyl-2-pyrrolidinone2-Pyrrolidinone, 5-cyclohexyl-5-ethyl-

Database identifiers

CAS: 6139-32-8
PubChem CID: 201515
DTXSID: DTXSID70976940

Properties

Computed structural properties

XLogP: 2.8
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 220

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