4-(4-piperidin-4-ylphenoxy)butan-1-ol

C15H23NO2 — CID 143066342

IUPAC4-(4-piperidin-4-ylphenoxy)butan-1-ol
SMILESOCCCCOc1ccc(C2CCNCC2)cc1
InChIInChI=1S/C15H23NO2/c17-11-1-2-12-18-15-5-3-13(4-6-15)14-7-9-16-10-8-14/h3-6,14,16-17H,1-2,7-12H2
InChIKeyFJFFEPPFSPSUAR-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.30
Rot. Bonds6

About 4-(4-piperidin-4-ylphenoxy)butan-1-ol

4-(4-piperidin-4-ylphenoxy)butan-1-ol (PubChem CID 143066342) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 4-(4-piperidin-4-ylphenoxy)butan-1-ol.

Molecular Properties

Compound Name4-(4-piperidin-4-ylphenoxy)butan-1-ol
PubChem CID143066342
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name4-(4-piperidin-4-ylphenoxy)butan-1-ol
SMILESOCCCCOc1ccc(C2CCNCC2)cc1
InChIInChI=1S/C15H23NO2/c17-11-1-2-12-18-15-5-3-13(4-6-15)14-7-9-16-10-8-14/h3-6,14,16-17H,1-2,7-12H2
InChIKeyFJFFEPPFSPSUAR-UHFFFAOYSA-N
XLogP2.30
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(4-octoxyphenyl)piperidine
CID 90176821
2-(4-piperidin-4-ylphenoxy)ethanamine
CID 115032196
4-[4-[3-(3,5-difluorophenoxy)propoxy]phenyl]piperidine
CID 67598806
4-(4-ethoxyphenyl)piperidine
CID 21495191
N,N-dimethyl-2-(4-piperidin-4-ylphenoxy)ethanamine;hydrochloride
CID 164705135
6-[4-(4-propylcyclohexyl)phenoxy]hexan-1-ol
CID 67066834
4-[4-[3-(2-chlorophenoxy)propoxy]phenyl]piperidine
CID 70333215
4-[4-[3-(thiophen-3-ylmethoxy)propoxy]phenyl]piperidine
CID 142663971
4-[4-[[(1S)-2,2-difluorocyclopropyl]methoxy]phenyl]piperidine
CID 129387347
4-[4-[4-(4-hydroxybutoxy)phenyl]phenoxy]butan-1-ol
CID 71340264
3-[4-(5-hydroxypentoxy)phenyl]piperidine-2,6-dione
CID 172584861
8-[4-[4-[4-(4-pentylcyclohexyl)cyclohexyl]phenyl]phenoxy]octan-1-ol
CID 154928109

Frequently Asked Questions

What is the IUPAC name of 4-(4-piperidin-4-ylphenoxy)butan-1-ol?
The IUPAC name of 4-(4-piperidin-4-ylphenoxy)butan-1-ol (CID 143066342) is 4-(4-piperidin-4-ylphenoxy)butan-1-ol.
What is the SMILES notation for 4-(4-piperidin-4-ylphenoxy)butan-1-ol?
The canonical SMILES for 4-(4-piperidin-4-ylphenoxy)butan-1-ol is OCCCCOc1ccc(C2CCNCC2)cc1.
What is the InChIKey of 4-(4-piperidin-4-ylphenoxy)butan-1-ol?
The InChIKey is FJFFEPPFSPSUAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c17-11-1-2-12-18-15-5-3-13(4-6-15)14-7-9-16-10-8-14/h3-6,14,16-17H,1-2,7-12H2.
What are the key properties of 4-(4-piperidin-4-ylphenoxy)butan-1-ol?
4-(4-piperidin-4-ylphenoxy)butan-1-ol has a molecular weight of 249.35 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-piperidin-4-ylphenoxy)butan-1-ol is sourced from PubChem (CID 143066342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).