(3R)-3-(2-piperidin-4-ylphenoxy)piperidine

C16H24N2O — CID 58817373

IUPAC(3R)-3-(2-piperidin-4-ylphenoxy)piperidine
SMILESc1ccc(C2CCNCC2)c(O[C@@H]2CCCNC2)c1
InChIInChI=1S/C16H24N2O/c1-2-6-16(19-14-4-3-9-18-12-14)15(5-1)13-7-10-17-11-8-13/h1-2,5-6,13-14,17-18H,3-4,7-12H2/t14-/m1/s1
InChIKeyNIWXRZZYMMRZGJ-CQSZACIVSA-N
MW260.38 g/mol
LogP2.28
Rot. Bonds3

About (3R)-3-(2-piperidin-4-ylphenoxy)piperidine

(3R)-3-(2-piperidin-4-ylphenoxy)piperidine (PubChem CID 58817373) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is (3R)-3-(2-piperidin-4-ylphenoxy)piperidine.

Molecular Properties

Compound Name(3R)-3-(2-piperidin-4-ylphenoxy)piperidine
PubChem CID58817373
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name(3R)-3-(2-piperidin-4-ylphenoxy)piperidine
SMILESc1ccc(C2CCNCC2)c(O[C@@H]2CCCNC2)c1
InChIInChI=1S/C16H24N2O/c1-2-6-16(19-14-4-3-9-18-12-14)15(5-1)13-7-10-17-11-8-13/h1-2,5-6,13-14,17-18H,3-4,7-12H2/t14-/m1/s1
InChIKeyNIWXRZZYMMRZGJ-CQSZACIVSA-N
XLogP2.28
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-(2-piperidin-4-ylphenoxy)piperidine?
The IUPAC name of (3R)-3-(2-piperidin-4-ylphenoxy)piperidine (CID 58817373) is (3R)-3-(2-piperidin-4-ylphenoxy)piperidine.
What is the SMILES notation for (3R)-3-(2-piperidin-4-ylphenoxy)piperidine?
The canonical SMILES for (3R)-3-(2-piperidin-4-ylphenoxy)piperidine is c1ccc(C2CCNCC2)c(O[C@@H]2CCCNC2)c1.
What is the InChIKey of (3R)-3-(2-piperidin-4-ylphenoxy)piperidine?
The InChIKey is NIWXRZZYMMRZGJ-CQSZACIVSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-6-16(19-14-4-3-9-18-12-14)15(5-1)13-7-10-17-11-8-13/h1-2,5-6,13-14,17-18H,3-4,7-12H2/t14-/m1/s1.
What are the key properties of (3R)-3-(2-piperidin-4-ylphenoxy)piperidine?
(3R)-3-(2-piperidin-4-ylphenoxy)piperidine has a molecular weight of 260.38 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(2-piperidin-4-ylphenoxy)piperidine is sourced from PubChem (CID 58817373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).