4-(4-phenyl-1,3-dioxolan-2-yl)piperidine

C14H19NO2 — CID 82184358

IUPAC4-(4-phenyl-1,3-dioxolan-2-yl)piperidine
SMILESc1ccc(C2COC(C3CCNCC3)O2)cc1
InChIInChI=1S/C14H19NO2/c1-2-4-11(5-3-1)13-10-16-14(17-13)12-6-8-15-9-7-12/h1-5,12-15H,6-10H2
InChIKeyLGNYNAGGJBETOU-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.10
Rot. Bonds2

About 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine

4-(4-phenyl-1,3-dioxolan-2-yl)piperidine (PubChem CID 82184358) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine.

Molecular Properties

Compound Name4-(4-phenyl-1,3-dioxolan-2-yl)piperidine
PubChem CID82184358
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name4-(4-phenyl-1,3-dioxolan-2-yl)piperidine
SMILESc1ccc(C2COC(C3CCNCC3)O2)cc1
InChIInChI=1S/C14H19NO2/c1-2-4-11(5-3-1)13-10-16-14(17-13)12-6-8-15-9-7-12/h1-5,12-15H,6-10H2
InChIKeyLGNYNAGGJBETOU-UHFFFAOYSA-N
XLogP2.10
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4S)-2-methyl-4-phenyl-1,3-dioxolane
CID 10374766
2-phenyloxirane
CID 7276
2,6-diphenylmorpholine
CID 43381979
(3R,4aS,8aS)-3-phenyl-3,4a,8,8a-tetrahydro-2H-pyrano[2,3-b][1,4]dioxin-7-one
CID 162410186
ethane;2-phenyloxirane
CID 54171856
4-phenylpiperidine;sulfane;hydrochloride
CID 174499697
methanamine;4-phenylpiperidine
CID 143444696
azane;2-phenylmorpholine
CID 174664757
(5R)-5-phenyl-1,4-diazepane
CID 124583394
(3S,5R)-5-phenyloxolan-3-ol
CID 97052112
2-phenyl-3,4,5,6-tetrahydro-2H-1,5-benzoxazocine
CID 12951842
4-phenylazocane
CID 19847318

Frequently Asked Questions

What is the IUPAC name of 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine?
The IUPAC name of 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine (CID 82184358) is 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine.
What is the SMILES notation for 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine?
The canonical SMILES for 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine is c1ccc(C2COC(C3CCNCC3)O2)cc1.
What is the InChIKey of 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine?
The InChIKey is LGNYNAGGJBETOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-4-11(5-3-1)13-10-16-14(17-13)12-6-8-15-9-7-12/h1-5,12-15H,6-10H2.
What are the key properties of 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine?
4-(4-phenyl-1,3-dioxolan-2-yl)piperidine has a molecular weight of 233.31 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-phenyl-1,3-dioxolan-2-yl)piperidine is sourced from PubChem (CID 82184358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).