4-methyl-4-(2-methylbutan-2-yl)piperidine

C11H23N — CID 90425347

IUPAC4-methyl-4-(2-methylbutan-2-yl)piperidine
SMILESCCC(C)(C)C1(C)CCNCC1
InChIInChI=1S/C11H23N/c1-5-10(2,3)11(4)6-8-12-9-7-11/h12H,5-9H2,1-4H3
InChIKeyWVTUBMZRYWLNRF-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.81
Rot. Bonds2

About 4-methyl-4-(2-methylbutan-2-yl)piperidine

4-methyl-4-(2-methylbutan-2-yl)piperidine (PubChem CID 90425347) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 4-methyl-4-(2-methylbutan-2-yl)piperidine.

Molecular Properties

Compound Name4-methyl-4-(2-methylbutan-2-yl)piperidine
PubChem CID90425347
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name4-methyl-4-(2-methylbutan-2-yl)piperidine
SMILESCCC(C)(C)C1(C)CCNCC1
InChIInChI=1S/C11H23N/c1-5-10(2,3)11(4)6-8-12-9-7-11/h12H,5-9H2,1-4H3
InChIKeyWVTUBMZRYWLNRF-UHFFFAOYSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-(2-methylbutan-2-yl)piperidine?
The IUPAC name of 4-methyl-4-(2-methylbutan-2-yl)piperidine (CID 90425347) is 4-methyl-4-(2-methylbutan-2-yl)piperidine.
What is the SMILES notation for 4-methyl-4-(2-methylbutan-2-yl)piperidine?
The canonical SMILES for 4-methyl-4-(2-methylbutan-2-yl)piperidine is CCC(C)(C)C1(C)CCNCC1.
What is the InChIKey of 4-methyl-4-(2-methylbutan-2-yl)piperidine?
The InChIKey is WVTUBMZRYWLNRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-5-10(2,3)11(4)6-8-12-9-7-11/h12H,5-9H2,1-4H3.
What are the key properties of 4-methyl-4-(2-methylbutan-2-yl)piperidine?
4-methyl-4-(2-methylbutan-2-yl)piperidine has a molecular weight of 169.31 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-(2-methylbutan-2-yl)piperidine is sourced from PubChem (CID 90425347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).