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

C11H23NO — CID 22960534

IUPAC1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
SMILESCN1CCCCC1COC(C)(C)C
InChIInChI=1S/C11H23NO/c1-11(2,3)13-9-10-7-5-6-8-12(10)4/h10H,5-9H2,1-4H3
InChIKeyITYMQCAIHDJRPI-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.29
Rot. Bonds2

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

1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine (PubChem CID 22960534) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine.

Molecular Properties

Compound Name1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
PubChem CID22960534
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
SMILESCN1CCCCC1COC(C)(C)C
InChIInChI=1S/C11H23NO/c1-11(2,3)13-9-10-7-5-6-8-12(10)4/h10H,5-9H2,1-4H3
InChIKeyITYMQCAIHDJRPI-UHFFFAOYSA-N
XLogP2.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The IUPAC name of 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine (CID 22960534) is 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine.
What is the SMILES notation for 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The canonical SMILES for 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine is CN1CCCCC1COC(C)(C)C.
What is the InChIKey of 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The InChIKey is ITYMQCAIHDJRPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-11(2,3)13-9-10-7-5-6-8-12(10)4/h10H,5-9H2,1-4H3.
What are the key properties of 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine?
1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine has a molecular weight of 185.31 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine is sourced from PubChem (CID 22960534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).