4-(Methoxymethyl)-N-phenylpiperidin-4-amine

HCID 18319932

Notes Reactions

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Basic information

CAS: 61380-03-8
Standard SMILES: COCC1(Nc2ccccc2)CCNCC1
InChIKey: MWJKXKBVWIHKOB-UHFFFAOYSA-N
Molecular formula: C13H20N2O
Average molar mass: 220.31 g/mol
Monoisotopic mass: 220.15756327

Names & identifiers

Preferred name: 4-(Methoxymethyl)-N-phenylpiperidin-4-amine
IUPAC: 4-(methoxymethyl)-N-phenylpiperidin-4-amine

Names & synonyms

61380-03-84-(Methoxymethyl)-N-phenylpiperidin-4-amine4-Piperidinamine, 4-(methoxymethyl)-N-phenyl-4-(methoxymethyl)-N-phenyl-4-piperidinamineSCHEMBL6122826DTXSID30592761MWJKXKBVWIHKOB-UHFFFAOYSA-NDB-212410

Database identifiers

CAS: 61380-03-8
PubChem CID: 18319932
DTXSID: DTXSID30592761

Properties

Computed structural properties

XLogP: 1.7
Topological polar surface area: 33.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 16
Formal charge: 0
Complexity: 196

Related reactions

25 records

New reaction record

HRID 26770As productuspto-grants-1979_04

HRID 26771As reactantuspto-grants-1979_04

HRID 28161As productuspto-grants-1980_09

HRID 28162As reactantuspto-grants-1980_09

HRID 203312As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 236776As productuspto-grants-1979_06

HRID 236777As reactantuspto-grants-1979_06

HRID 296803As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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