4-tert-butyl-5,5-diethyl-2-methoxypiperidine

C14H29NO — CID 167283914

IUPAC4-tert-butyl-5,5-diethyl-2-methoxypiperidine
SMILESCCC1(CC)CNC(OC)CC1C(C)(C)C
InChIInChI=1S/C14H29NO/c1-7-14(8-2)10-15-12(16-6)9-11(14)13(3,4)5/h11-12,15H,7-10H2,1-6H3
InChIKeyHVNIYLSOZFRHQF-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.42
Rot. Bonds3

About 4-tert-butyl-5,5-diethyl-2-methoxypiperidine

4-tert-butyl-5,5-diethyl-2-methoxypiperidine (PubChem CID 167283914) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 4-tert-butyl-5,5-diethyl-2-methoxypiperidine.

Molecular Properties

Compound Name4-tert-butyl-5,5-diethyl-2-methoxypiperidine
PubChem CID167283914
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name4-tert-butyl-5,5-diethyl-2-methoxypiperidine
SMILESCCC1(CC)CNC(OC)CC1C(C)(C)C
InChIInChI=1S/C14H29NO/c1-7-14(8-2)10-15-12(16-6)9-11(14)13(3,4)5/h11-12,15H,7-10H2,1-6H3
InChIKeyHVNIYLSOZFRHQF-UHFFFAOYSA-N
XLogP3.42
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-5,5-diethyl-2-methoxypiperidine?
The IUPAC name of 4-tert-butyl-5,5-diethyl-2-methoxypiperidine (CID 167283914) is 4-tert-butyl-5,5-diethyl-2-methoxypiperidine.
What is the SMILES notation for 4-tert-butyl-5,5-diethyl-2-methoxypiperidine?
The canonical SMILES for 4-tert-butyl-5,5-diethyl-2-methoxypiperidine is CCC1(CC)CNC(OC)CC1C(C)(C)C.
What is the InChIKey of 4-tert-butyl-5,5-diethyl-2-methoxypiperidine?
The InChIKey is HVNIYLSOZFRHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-7-14(8-2)10-15-12(16-6)9-11(14)13(3,4)5/h11-12,15H,7-10H2,1-6H3.
What are the key properties of 4-tert-butyl-5,5-diethyl-2-methoxypiperidine?
4-tert-butyl-5,5-diethyl-2-methoxypiperidine has a molecular weight of 227.39 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-5,5-diethyl-2-methoxypiperidine is sourced from PubChem (CID 167283914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).