O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine

C14H22N2O3 — CID 117420163

IUPACO-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine
SMILESCOc1ccc(CCON)cc1OC1CCCNC1
InChIInChI=1S/C14H22N2O3/c1-17-13-5-4-11(6-8-18-15)9-14(13)19-12-3-2-7-16-10-12/h4-5,9,12,16H,2-3,6-8,10,15H2,1H3
InChIKeyIIPSBKWOIPZMJD-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.26
Rot. Bonds6

About O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine

O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine (PubChem CID 117420163) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine.

Molecular Properties

Compound NameO-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine
PubChem CID117420163
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameO-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine
SMILESCOc1ccc(CCON)cc1OC1CCCNC1
InChIInChI=1S/C14H22N2O3/c1-17-13-5-4-11(6-8-18-15)9-14(13)19-12-3-2-7-16-10-12/h4-5,9,12,16H,2-3,6-8,10,15H2,1H3
InChIKeyIIPSBKWOIPZMJD-UHFFFAOYSA-N
XLogP1.26
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethanol
CID 115005664
3-[2-methoxy-5-(piperidin-4-ylmethyl)phenoxy]piperidine
CID 117489948
O-[2-[4-methoxy-3-(thian-3-yloxy)phenyl]ethyl]hydroxylamine
CID 117455774
O-[2-[4-methoxy-3-(1-methylazetidin-3-yl)oxyphenyl]ethyl]hydroxylamine
CID 117384188
O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine
CID 117450339
3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]pyrrolidine
CID 174896705
2-(3-cyclobutyloxy-4-methoxyphenyl)ethanol
CID 117318425
3-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]piperidine
CID 117467787
O-[2-(3-cyclohexyl-4-methoxyphenyl)ethyl]hydroxylamine
CID 117377552
(3R)-3-(4-ethyl-2-methoxyphenoxy)pyrrolidine
CID 107664998
[3-methoxy-4-[(3S)-pyrrolidin-3-yl]oxyphenyl]methanol
CID 107743165
2-(3-fluoro-4-piperidin-3-yloxyphenyl)ethanol
CID 170887452

Frequently Asked Questions

What is the IUPAC name of O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine?
The IUPAC name of O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine (CID 117420163) is O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine.
What is the SMILES notation for O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine?
The canonical SMILES for O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine is COc1ccc(CCON)cc1OC1CCCNC1.
What is the InChIKey of O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine?
The InChIKey is IIPSBKWOIPZMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-17-13-5-4-11(6-8-18-15)9-14(13)19-12-3-2-7-16-10-12/h4-5,9,12,16H,2-3,6-8,10,15H2,1H3.
What are the key properties of O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine?
O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine has a molecular weight of 266.34 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine is sourced from PubChem (CID 117420163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).