2-(2-cyclobutylethyl)-4-methylpiperidine

C12H23N — CID 130804318

IUPAC2-(2-cyclobutylethyl)-4-methylpiperidine
SMILESCC1CCNC(CCC2CCC2)C1
InChIInChI=1S/C12H23N/c1-10-7-8-13-12(9-10)6-5-11-3-2-4-11/h10-13H,2-9H2,1H3
InChIKeyMMPXGOCLZYAZGO-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.95
Rot. Bonds3

About 2-(2-cyclobutylethyl)-4-methylpiperidine

2-(2-cyclobutylethyl)-4-methylpiperidine (PubChem CID 130804318) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 2-(2-cyclobutylethyl)-4-methylpiperidine.

Molecular Properties

Compound Name2-(2-cyclobutylethyl)-4-methylpiperidine
PubChem CID130804318
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name2-(2-cyclobutylethyl)-4-methylpiperidine
SMILESCC1CCNC(CCC2CCC2)C1
InChIInChI=1S/C12H23N/c1-10-7-8-13-12(9-10)6-5-11-3-2-4-11/h10-13H,2-9H2,1H3
InChIKeyMMPXGOCLZYAZGO-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;2-ethyl-4-methylpiperidine
CID 142379207
[(2R,4S)-4-methylpiperidin-2-yl]methanol
CID 68711333
[(2R,4R)-4-methylpiperidin-2-yl]methanol
CID 68714845
4-methyl-2-(piperidin-2-ylmethyl)piperidine
CID 121010595
2-(2-cyclopropylethyl)pyrrolidine
CID 23166213
2-(2-cyclopropylethyl)-4-(trifluoromethyl)piperidine
CID 106779886
(4R)-2,4-dimethylpiperidine
CID 144551274
3-[(4-methylpiperidin-2-yl)methyl]-3-azabicyclo[3.1.0]hexane
CID 131185799
2-methyl-1-[(4-methylpiperidin-2-yl)methyl]azepane
CID 114421553
2-[2-(2,4-dichloro-5-fluorophenyl)ethyl]-4-methylpiperidine
CID 116686192
3-methyl-1-(4-methylpiperidin-2-yl)butan-2-one
CID 116685291
3-(2-cyclopentylethyl)morpholine
CID 116928258

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclobutylethyl)-4-methylpiperidine?
The IUPAC name of 2-(2-cyclobutylethyl)-4-methylpiperidine (CID 130804318) is 2-(2-cyclobutylethyl)-4-methylpiperidine.
What is the SMILES notation for 2-(2-cyclobutylethyl)-4-methylpiperidine?
The canonical SMILES for 2-(2-cyclobutylethyl)-4-methylpiperidine is CC1CCNC(CCC2CCC2)C1.
What is the InChIKey of 2-(2-cyclobutylethyl)-4-methylpiperidine?
The InChIKey is MMPXGOCLZYAZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-10-7-8-13-12(9-10)6-5-11-3-2-4-11/h10-13H,2-9H2,1H3.
What are the key properties of 2-(2-cyclobutylethyl)-4-methylpiperidine?
2-(2-cyclobutylethyl)-4-methylpiperidine has a molecular weight of 181.32 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclobutylethyl)-4-methylpiperidine is sourced from PubChem (CID 130804318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).