(3R)-3-[(1S)-1-phenylethoxy]piperidine

C13H19NO — CID 129369907

IUPAC(3R)-3-[(1S)-1-phenylethoxy]piperidine
SMILESC[C@H](O[C@@H]1CCCNC1)c1ccccc1
InChIInChI=1S/C13H19NO/c1-11(12-6-3-2-4-7-12)15-13-8-5-9-14-10-13/h2-4,6-7,11,13-14H,5,8-10H2,1H3/t11-,13+/m0/s1
InChIKeyRSDFTWILXXYBMB-WCQYABFASA-N
MW205.30 g/mol
LogP2.52
Rot. Bonds3

About (3R)-3-[(1S)-1-phenylethoxy]piperidine

(3R)-3-[(1S)-1-phenylethoxy]piperidine (PubChem CID 129369907) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (3R)-3-[(1S)-1-phenylethoxy]piperidine.

Molecular Properties

Compound Name(3R)-3-[(1S)-1-phenylethoxy]piperidine
PubChem CID129369907
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(3R)-3-[(1S)-1-phenylethoxy]piperidine
SMILESC[C@H](O[C@@H]1CCCNC1)c1ccccc1
InChIInChI=1S/C13H19NO/c1-11(12-6-3-2-4-7-12)15-13-8-5-9-14-10-13/h2-4,6-7,11,13-14H,5,8-10H2,1H3/t11-,13+/m0/s1
InChIKeyRSDFTWILXXYBMB-WCQYABFASA-N
XLogP2.52
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-benzhydryloxypiperidine
CID 2762417
(3R)-3-[(1S)-1-(1H-pyrrol-2-yl)ethoxy]piperidine
CID 97162337
2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride
CID 71637869
2-phenyl-2-piperidin-3-yloxyacetamide
CID 102567779
3-[2-(1-phenylethoxy)ethyl]piperidine
CID 62355840
3-propan-2-yloxypiperidine;hydrochloride
CID 53409755
(3R)-3-phenoxypiperidine
CID 42553363
3-(3-propan-2-ylphenoxy)piperidine
CID 45075406
1-cyclohexyloxy-1-phenylpropan-2-amine
CID 55017556
(3S)-3-(1-thiophen-2-ylethoxy)pyrrolidine;hydrochloride
CID 71637903
(3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine
CID 86322666
(R)-phenyl-[(3S)-piperidin-3-yl]methanol
CID 39238461

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[(1S)-1-phenylethoxy]piperidine?
The IUPAC name of (3R)-3-[(1S)-1-phenylethoxy]piperidine (CID 129369907) is (3R)-3-[(1S)-1-phenylethoxy]piperidine.
What is the SMILES notation for (3R)-3-[(1S)-1-phenylethoxy]piperidine?
The canonical SMILES for (3R)-3-[(1S)-1-phenylethoxy]piperidine is C[C@H](O[C@@H]1CCCNC1)c1ccccc1.
What is the InChIKey of (3R)-3-[(1S)-1-phenylethoxy]piperidine?
The InChIKey is RSDFTWILXXYBMB-WCQYABFASA-N. The full InChI is InChI=1S/C13H19NO/c1-11(12-6-3-2-4-7-12)15-13-8-5-9-14-10-13/h2-4,6-7,11,13-14H,5,8-10H2,1H3/t11-,13+/m0/s1.
What are the key properties of (3R)-3-[(1S)-1-phenylethoxy]piperidine?
(3R)-3-[(1S)-1-phenylethoxy]piperidine has a molecular weight of 205.30 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[(1S)-1-phenylethoxy]piperidine is sourced from PubChem (CID 129369907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).