1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine

C12H25NO — CID 58365051

IUPAC1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
SMILESCCN1CCCCC1COC(C)(C)C
InChIInChI=1S/C12H25NO/c1-5-13-9-7-6-8-11(13)10-14-12(2,3)4/h11H,5-10H2,1-4H3
InChIKeyZXXLFQHLVLKVKX-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.68
Rot. Bonds3

About 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine

1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine (PubChem CID 58365051) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine.

Molecular Properties

Compound Name1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
PubChem CID58365051
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
SMILESCCN1CCCCC1COC(C)(C)C
InChIInChI=1S/C12H25NO/c1-5-13-9-7-6-8-11(13)10-14-12(2,3)4/h11H,5-10H2,1-4H3
InChIKeyZXXLFQHLVLKVKX-UHFFFAOYSA-N
XLogP2.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The IUPAC name of 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine (CID 58365051) is 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine.
What is the SMILES notation for 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The canonical SMILES for 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine is CCN1CCCCC1COC(C)(C)C.
What is the InChIKey of 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The InChIKey is ZXXLFQHLVLKVKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-5-13-9-7-6-8-11(13)10-14-12(2,3)4/h11H,5-10H2,1-4H3.
What are the key properties of 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine?
1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine has a molecular weight of 199.34 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine is sourced from PubChem (CID 58365051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).