1-phenyl-N-phenylmethoxypiperidin-4-amine

C18H22N2O — CID 106820391

IUPAC1-phenyl-N-phenylmethoxypiperidin-4-amine
SMILESc1ccc(CONC2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C18H22N2O/c1-3-7-16(8-4-1)15-21-19-17-11-13-20(14-12-17)18-9-5-2-6-10-18/h1-10,17,19H,11-15H2
InChIKeySTTQHEITZYASNC-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.38
Rot. Bonds5

About 1-phenyl-N-phenylmethoxypiperidin-4-amine

1-phenyl-N-phenylmethoxypiperidin-4-amine (PubChem CID 106820391) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-phenyl-N-phenylmethoxypiperidin-4-amine.

Molecular Properties

Compound Name1-phenyl-N-phenylmethoxypiperidin-4-amine
PubChem CID106820391
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name1-phenyl-N-phenylmethoxypiperidin-4-amine
SMILESc1ccc(CONC2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C18H22N2O/c1-3-7-16(8-4-1)15-21-19-17-11-13-20(14-12-17)18-9-5-2-6-10-18/h1-10,17,19H,11-15H2
InChIKeySTTQHEITZYASNC-UHFFFAOYSA-N
XLogP3.38
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-phenylmethoxypiperidin-4-amine?
The IUPAC name of 1-phenyl-N-phenylmethoxypiperidin-4-amine (CID 106820391) is 1-phenyl-N-phenylmethoxypiperidin-4-amine.
What is the SMILES notation for 1-phenyl-N-phenylmethoxypiperidin-4-amine?
The canonical SMILES for 1-phenyl-N-phenylmethoxypiperidin-4-amine is c1ccc(CONC2CCN(c3ccccc3)CC2)cc1.
What is the InChIKey of 1-phenyl-N-phenylmethoxypiperidin-4-amine?
The InChIKey is STTQHEITZYASNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-3-7-16(8-4-1)15-21-19-17-11-13-20(14-12-17)18-9-5-2-6-10-18/h1-10,17,19H,11-15H2.
What are the key properties of 1-phenyl-N-phenylmethoxypiperidin-4-amine?
1-phenyl-N-phenylmethoxypiperidin-4-amine has a molecular weight of 282.39 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-phenylmethoxypiperidin-4-amine is sourced from PubChem (CID 106820391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).