O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine

C13H20N2O — CID 117314763

IUPACO-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine
SMILESNOCCc1ccccc1C1CCNCC1
InChIInChI=1S/C13H20N2O/c14-16-10-7-11-3-1-2-4-13(11)12-5-8-15-9-6-12/h1-4,12,15H,5-10,14H2
InChIKeyZQSZKSCMVMFTHT-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.59
Rot. Bonds4

About O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine

O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine (PubChem CID 117314763) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine.

Molecular Properties

Compound NameO-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine
PubChem CID117314763
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameO-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine
SMILESNOCCc1ccccc1C1CCNCC1
InChIInChI=1S/C13H20N2O/c14-16-10-7-11-3-1-2-4-13(11)12-5-8-15-9-6-12/h1-4,12,15H,5-10,14H2
InChIKeyZQSZKSCMVMFTHT-UHFFFAOYSA-N
XLogP1.59
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine?
The IUPAC name of O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine (CID 117314763) is O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine.
What is the SMILES notation for O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine?
The canonical SMILES for O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine is NOCCc1ccccc1C1CCNCC1.
What is the InChIKey of O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine?
The InChIKey is ZQSZKSCMVMFTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c14-16-10-7-11-3-1-2-4-13(11)12-5-8-15-9-6-12/h1-4,12,15H,5-10,14H2.
What are the key properties of O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine?
O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine has a molecular weight of 220.32 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine is sourced from PubChem (CID 117314763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).