4-[4-(oxetan-3-yl)phenyl]piperidine

C14H19NO — CID 83836156

IUPAC4-[4-(oxetan-3-yl)phenyl]piperidine
SMILESc1cc(C2COC2)ccc1C1CCNCC1
InChIInChI=1S/C14H19NO/c1-3-12(14-9-16-10-14)4-2-11(1)13-5-7-15-8-6-13/h1-4,13-15H,5-10H2
InChIKeyNXZICUHWZVUGHB-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.27
Rot. Bonds2

About 4-[4-(oxetan-3-yl)phenyl]piperidine

4-[4-(oxetan-3-yl)phenyl]piperidine (PubChem CID 83836156) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 4-[4-(oxetan-3-yl)phenyl]piperidine.

Molecular Properties

Compound Name4-[4-(oxetan-3-yl)phenyl]piperidine
PubChem CID83836156
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name4-[4-(oxetan-3-yl)phenyl]piperidine
SMILESc1cc(C2COC2)ccc1C1CCNCC1
InChIInChI=1S/C14H19NO/c1-3-12(14-9-16-10-14)4-2-11(1)13-5-7-15-8-6-13/h1-4,13-15H,5-10H2
InChIKeyNXZICUHWZVUGHB-UHFFFAOYSA-N
XLogP2.27
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

potassium 4-piperidin-4-ylphenolate
CID 143791971
ethane;4-(4-fluorophenyl)piperidine
CID 144692128
4-(4-bromophenyl)piperidine;hydrochloride
CID 44630758
ethane;4-(4-methylphenyl)piperidine
CID 145467036
4-(4-cyclohexylphenyl)azepane
CID 82300190
3-(4-piperidin-4-ylphenyl)oxetane-3-carbonitrile
CID 116988102
4-(4-chlorophenyl)piperidine;ethane
CID 143751340
4-[4-[4-(4-phenylphenyl)phenyl]phenyl]piperidine
CID 146643621
trimethyl-(4-piperidin-4-ylphenoxy)silane
CID 167737433
4-phenylpiperidine;sulfane;hydrochloride
CID 174499697
(4-piperidin-4-ylphenyl)methanethiol
CID 116988080
4-(4-piperidin-4-ylphenyl)aniline
CID 116988069

Frequently Asked Questions

What is the IUPAC name of 4-[4-(oxetan-3-yl)phenyl]piperidine?
The IUPAC name of 4-[4-(oxetan-3-yl)phenyl]piperidine (CID 83836156) is 4-[4-(oxetan-3-yl)phenyl]piperidine.
What is the SMILES notation for 4-[4-(oxetan-3-yl)phenyl]piperidine?
The canonical SMILES for 4-[4-(oxetan-3-yl)phenyl]piperidine is c1cc(C2COC2)ccc1C1CCNCC1.
What is the InChIKey of 4-[4-(oxetan-3-yl)phenyl]piperidine?
The InChIKey is NXZICUHWZVUGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-3-12(14-9-16-10-14)4-2-11(1)13-5-7-15-8-6-13/h1-4,13-15H,5-10H2.
What are the key properties of 4-[4-(oxetan-3-yl)phenyl]piperidine?
4-[4-(oxetan-3-yl)phenyl]piperidine has a molecular weight of 217.31 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(oxetan-3-yl)phenyl]piperidine is sourced from PubChem (CID 83836156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).