(3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine

C15H23NO — CID 86322666

IUPAC(3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine
SMILESCC(C)c1ccc(CO[C@@H]2CCCNC2)cc1
InChIInChI=1S/C15H23NO/c1-12(2)14-7-5-13(6-8-14)11-17-15-4-3-9-16-10-15/h5-8,12,15-16H,3-4,9-11H2,1-2H3/t15-/m1/s1
InChIKeyOWLYNBFPSUUCDD-OAHLLOKOSA-N
MW233.36 g/mol
LogP3.08
Rot. Bonds4

About (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine

(3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine (PubChem CID 86322666) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine.

Molecular Properties

Compound Name(3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine
PubChem CID86322666
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name(3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine
SMILESCC(C)c1ccc(CO[C@@H]2CCCNC2)cc1
InChIInChI=1S/C15H23NO/c1-12(2)14-7-5-13(6-8-14)11-17-15-4-3-9-16-10-15/h5-8,12,15-16H,3-4,9-11H2,1-2H3/t15-/m1/s1
InChIKeyOWLYNBFPSUUCDD-OAHLLOKOSA-N
XLogP3.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4-propan-2-ylphenyl)methoxymethyl]piperidine
CID 55060808
2-chloro-5-[[(3R)-piperidin-3-yl]oxymethyl]pyridine
CID 71639891
2-chloro-5-[[(3S)-piperidin-3-yl]oxymethyl]pyridine;hydrochloride
CID 71639892
2-chloro-5-[[(3R)-piperidin-3-yl]oxymethyl]pyridine;hydrochloride
CID 71639890
(3S)-3-(thiophen-3-ylmethoxy)piperidine
CID 66247968
(3S)-3-[(3-bromo-4-methoxyphenyl)methoxy]piperidine
CID 66245010
(3S)-3-[(3-fluoro-4-methoxyphenyl)methoxy]piperidine
CID 66247179
(3S)-3-[(4-propan-2-ylphenyl)methoxymethyl]pyrrolidine
CID 86325447
1-propan-2-yl-4-[(3-propan-2-ylcyclobutyl)oxymethyl]benzene
CID 177122881
3-[(4-iodophenyl)methoxy]pyrrolidine;hydrochloride
CID 53409439
3-(1H-pyrazol-4-ylmethoxy)piperidine
CID 130569410
3-[(3-bromophenyl)methoxy]piperidine
CID 53409415

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine?
The IUPAC name of (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine (CID 86322666) is (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine.
What is the SMILES notation for (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine?
The canonical SMILES for (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine is CC(C)c1ccc(CO[C@@H]2CCCNC2)cc1.
What is the InChIKey of (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine?
The InChIKey is OWLYNBFPSUUCDD-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H23NO/c1-12(2)14-7-5-13(6-8-14)11-17-15-4-3-9-16-10-15/h5-8,12,15-16H,3-4,9-11H2,1-2H3/t15-/m1/s1.
What are the key properties of (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine?
(3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine has a molecular weight of 233.36 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[(4-propan-2-ylphenyl)methoxy]piperidine is sourced from PubChem (CID 86322666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).