(3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine

C15H21NO — CID 26191291

IUPAC(3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine
SMILESc1cc2c(c(O[C@@H]3CCCNC3)c1)CCCC2
InChIInChI=1S/C15H21NO/c1-2-8-14-12(5-1)6-3-9-15(14)17-13-7-4-10-16-11-13/h3,6,9,13,16H,1-2,4-5,7-8,10-11H2/t13-/m1/s1
InChIKeyUCVXIUQDUQFZAS-CYBMUJFWSA-N
MW231.34 g/mol
LogP2.70
Rot. Bonds2

About (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine

(3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine (PubChem CID 26191291) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine.

Molecular Properties

Compound Name(3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine
PubChem CID26191291
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name(3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine
SMILESc1cc2c(c(O[C@@H]3CCCNC3)c1)CCCC2
InChIInChI=1S/C15H21NO/c1-2-8-14-12(5-1)6-3-9-15(14)17-13-7-4-10-16-11-13/h3,6,9,13,16H,1-2,4-5,7-8,10-11H2/t13-/m1/s1
InChIKeyUCVXIUQDUQFZAS-CYBMUJFWSA-N
XLogP2.70
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine?
The IUPAC name of (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine (CID 26191291) is (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine.
What is the SMILES notation for (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine?
The canonical SMILES for (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine is c1cc2c(c(O[C@@H]3CCCNC3)c1)CCCC2.
What is the InChIKey of (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine?
The InChIKey is UCVXIUQDUQFZAS-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21NO/c1-2-8-14-12(5-1)6-3-9-15(14)17-13-7-4-10-16-11-13/h3,6,9,13,16H,1-2,4-5,7-8,10-11H2/t13-/m1/s1.
What are the key properties of (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine?
(3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine has a molecular weight of 231.34 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)piperidine is sourced from PubChem (CID 26191291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).