4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine

C12H25NO — CID 29078004

IUPAC4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine
SMILESCCC(C)(C)OCCC1CCNCC1
InChIInChI=1S/C12H25NO/c1-4-12(2,3)14-10-7-11-5-8-13-9-6-11/h11,13H,4-10H2,1-3H3
InChIKeyVSUBESWYPPCRNJ-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.58
Rot. Bonds5

About 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine

4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine (PubChem CID 29078004) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine
PubChem CID29078004
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine
SMILESCCC(C)(C)OCCC1CCNCC1
InChIInChI=1S/C12H25NO/c1-4-12(2,3)14-10-7-11-5-8-13-9-6-11/h11,13H,4-10H2,1-3H3
InChIKeyVSUBESWYPPCRNJ-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine?
The IUPAC name of 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine (CID 29078004) is 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine.
What is the SMILES notation for 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine?
The canonical SMILES for 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine is CCC(C)(C)OCCC1CCNCC1.
What is the InChIKey of 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine?
The InChIKey is VSUBESWYPPCRNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-4-12(2,3)14-10-7-11-5-8-13-9-6-11/h11,13H,4-10H2,1-3H3.
What are the key properties of 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine?
4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine has a molecular weight of 199.34 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methylbutan-2-yloxy)ethyl]piperidine is sourced from PubChem (CID 29078004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).