4-(1-Ethyl-piperidin-4-yl)phenylamine

HCID 67170989

Notes Reactions

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Basic information

Standard SMILES: CCN1CCC(c2ccc(N)cc2)CC1
InChIKey: HJDJNQZFHKFBIK-UHFFFAOYSA-N
Molecular formula: C13H20N2
Average molar mass: 204.31 g/mol
Monoisotopic mass: 204.16264865

Names & identifiers

Preferred name: 4-(1-Ethyl-piperidin-4-yl)phenylamine
IUPAC: 4-(1-ethylpiperidin-4-yl)aniline

Names & synonyms

943189-38-64-(1-ethyl-4-piperidyl)aniline4-(1-ethylpiperidin-4-yl)aniline4-(1-ethyl-piperidin-4-yl)phenylamineSCHEMBL1812772SCHEMBL2009102HJDJNQZFHKFBIK-UHFFFAOYSA-NAKOS023890032EBC-5162484-(1-Ethyl-Piperidin-4-yl)-phenylamineDB-339583

Database identifiers

PubChem CID: 67170989

Properties

Computed structural properties

XLogP: 2.2
Topological polar surface area: 29.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 15
Formal charge: 0
Complexity: 177

Related reactions

3 records

New reaction record

HRID 409676As productuspto-grants-2014_06

HRID 1153292As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 2066706As productuspto-grants-2012_10

Compound notes

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