N-(Cyclohexylmethyl)Pyrrolidine

HCID 199798

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 5005-27-6
Standard SMILES: C1CCC(CN2CCCC2)CC1
InChIKey: ADGIWWYGVBZYMC-UHFFFAOYSA-N
Molecular formula: C11H21N
Average molar mass: 167.29 g/mol
Monoisotopic mass: 167.16739967

Names & identifiers

Preferred name: N-(Cyclohexylmethyl)Pyrrolidine
IUPAC: 1-(cyclohexylmethyl)pyrrolidine

Names & synonyms

N-(Cyclohexylmethyl)Pyrrolidine5005-27-6DTXSID70276775RefChem:362661DTXCID90203487CHEMBL20306341-(cyclohexylmethyl)pyrrolidineSCHEMBL3439882SCHEMBL9557378SCHEMBL16337968BDBM50384293

Database identifiers

CAS: 5005-27-6
PubChem CID: 199798
DTXSID: DTXSID70276775
ChEMBL: CHEMBL2030634

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 3.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 12
Formal charge: 0
Complexity: 121

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…