4-[(2-methylpropan-2-yl)oxymethyl]piperidine

C10H21NO — CID 54056421

IUPAC4-[(2-methylpropan-2-yl)oxymethyl]piperidine
SMILESCC(C)(C)OCC1CCNCC1
InChIInChI=1S/C10H21NO/c1-10(2,3)12-8-9-4-6-11-7-5-9/h9,11H,4-8H2,1-3H3
InChIKeyLWOWJSCISLXIKL-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.80
Rot. Bonds2

About 4-[(2-methylpropan-2-yl)oxymethyl]piperidine

4-[(2-methylpropan-2-yl)oxymethyl]piperidine (PubChem CID 54056421) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-[(2-methylpropan-2-yl)oxymethyl]piperidine.

Molecular Properties

Compound Name4-[(2-methylpropan-2-yl)oxymethyl]piperidine
PubChem CID54056421
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-[(2-methylpropan-2-yl)oxymethyl]piperidine
SMILESCC(C)(C)OCC1CCNCC1
InChIInChI=1S/C10H21NO/c1-10(2,3)12-8-9-4-6-11-7-5-9/h9,11H,4-8H2,1-3H3
InChIKeyLWOWJSCISLXIKL-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The IUPAC name of 4-[(2-methylpropan-2-yl)oxymethyl]piperidine (CID 54056421) is 4-[(2-methylpropan-2-yl)oxymethyl]piperidine.
What is the SMILES notation for 4-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The canonical SMILES for 4-[(2-methylpropan-2-yl)oxymethyl]piperidine is CC(C)(C)OCC1CCNCC1.
What is the InChIKey of 4-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The InChIKey is LWOWJSCISLXIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-10(2,3)12-8-9-4-6-11-7-5-9/h9,11H,4-8H2,1-3H3.
What are the key properties of 4-[(2-methylpropan-2-yl)oxymethyl]piperidine?
4-[(2-methylpropan-2-yl)oxymethyl]piperidine has a molecular weight of 171.28 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylpropan-2-yl)oxymethyl]piperidine is sourced from PubChem (CID 54056421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).