(3R)-3-[(2-propylphenoxy)methyl]piperidine

C15H23NO — CID 86322759

IUPAC(3R)-3-[(2-propylphenoxy)methyl]piperidine
SMILESCCCc1ccccc1OC[C@@H]1CCCNC1
InChIInChI=1S/C15H23NO/c1-2-6-14-8-3-4-9-15(14)17-12-13-7-5-10-16-11-13/h3-4,8-9,13,16H,2,5-7,10-12H2,1H3/t13-/m1/s1
InChIKeyURIAEQPSUGSLOE-CYBMUJFWSA-N
MW233.35 g/mol
LogP3.02
Rot. Bonds5

About (3R)-3-[(2-propylphenoxy)methyl]piperidine

(3R)-3-[(2-propylphenoxy)methyl]piperidine (PubChem CID 86322759) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is (3R)-3-[(2-propylphenoxy)methyl]piperidine.

Molecular Properties

Compound Name(3R)-3-[(2-propylphenoxy)methyl]piperidine
PubChem CID86322759
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name(3R)-3-[(2-propylphenoxy)methyl]piperidine
SMILESCCCc1ccccc1OC[C@@H]1CCCNC1
InChIInChI=1S/C15H23NO/c1-2-6-14-8-3-4-9-15(14)17-12-13-7-5-10-16-11-13/h3-4,8-9,13,16H,2,5-7,10-12H2,1H3/t13-/m1/s1
InChIKeyURIAEQPSUGSLOE-CYBMUJFWSA-N
XLogP3.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-methylphenoxy)methyl]piperidine
CID 18524094
2-(piperidin-3-ylmethoxy)phenol;hydrochloride
CID 162016330
3-[[2-(2-methylpropoxy)phenoxy]methyl]piperidine
CID 68596368
3-[(2-chlorophenoxy)methyl]piperidine;hydrochloride
CID 45074918
(3R)-3-[(2-phenylphenoxy)methyl]piperidine
CID 26190683
difluoromethane;3-[(2-fluorophenoxy)methyl]piperidine
CID 166104221
3-[(2-methylsulfonylphenoxy)methyl]piperidine
CID 62348042
3-[(2-propoxyphenoxy)methyl]pyrrolidine
CID 55064564
ethyl 2-(piperidin-3-ylmethoxy)benzoate;hydrochloride
CID 56830906
2-(piperidin-3-ylmethoxy)-N-propylbenzenesulfonamide
CID 62348183
(3R)-3-[(4-bromo-2-ethylphenoxy)methyl]piperidine
CID 86321965
(3S)-3-(phenoxymethyl)piperidine
CID 26190643

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[(2-propylphenoxy)methyl]piperidine?
The IUPAC name of (3R)-3-[(2-propylphenoxy)methyl]piperidine (CID 86322759) is (3R)-3-[(2-propylphenoxy)methyl]piperidine.
What is the SMILES notation for (3R)-3-[(2-propylphenoxy)methyl]piperidine?
The canonical SMILES for (3R)-3-[(2-propylphenoxy)methyl]piperidine is CCCc1ccccc1OC[C@@H]1CCCNC1.
What is the InChIKey of (3R)-3-[(2-propylphenoxy)methyl]piperidine?
The InChIKey is URIAEQPSUGSLOE-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-6-14-8-3-4-9-15(14)17-12-13-7-5-10-16-11-13/h3-4,8-9,13,16H,2,5-7,10-12H2,1H3/t13-/m1/s1.
What are the key properties of (3R)-3-[(2-propylphenoxy)methyl]piperidine?
(3R)-3-[(2-propylphenoxy)methyl]piperidine has a molecular weight of 233.35 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[(2-propylphenoxy)methyl]piperidine is sourced from PubChem (CID 86322759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).