1-(trans-4-Ethoxycyclohexyl)piperidin-4-amine

HCID 58409113

Notes Reactions

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Basic information

Standard SMILES: CCOC1CCC(N2CCC(N)CC2)CC1
InChIKey: OZSDJABBRMFKKG-UHFFFAOYSA-N
Molecular formula: C13H26N2O
Average molar mass: 226.36 g/mol
Monoisotopic mass: 226.20451346

Names & identifiers

Preferred name: 1-(trans-4-Ethoxycyclohexyl)piperidin-4-amine
IUPAC: 1-(4-ethoxycyclohexyl)piperidin-4-amine

Names & synonyms

SCHEMBL602532SCHEMBL602533OZSDJABBRMFKKG-JOCQHMNTSA-N1-(trans-4-ethoxycyclohexyl)piperidin-4-amine

Database identifiers

PubChem CID: 58409113

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 38.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 194

Related reactions

7 records

New reaction record

HRID 104955As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 113371As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 122258As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 306581As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 1207019As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1219086As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 2330957As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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