3-(cyclobutylmethyl)-4-methylpiperidine

C11H21N — CID 106779274

IUPAC3-(cyclobutylmethyl)-4-methylpiperidine
SMILESCC1CCNCC1CC1CCC1
InChIInChI=1S/C11H21N/c1-9-5-6-12-8-11(9)7-10-3-2-4-10/h9-12H,2-8H2,1H3
InChIKeyBOUXJDCAUHDRAI-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.42
Rot. Bonds2

About 3-(cyclobutylmethyl)-4-methylpiperidine

3-(cyclobutylmethyl)-4-methylpiperidine (PubChem CID 106779274) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 3-(cyclobutylmethyl)-4-methylpiperidine.

Molecular Properties

Compound Name3-(cyclobutylmethyl)-4-methylpiperidine
PubChem CID106779274
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name3-(cyclobutylmethyl)-4-methylpiperidine
SMILESCC1CCNCC1CC1CCC1
InChIInChI=1S/C11H21N/c1-9-5-6-12-8-11(9)7-10-3-2-4-10/h9-12H,2-8H2,1H3
InChIKeyBOUXJDCAUHDRAI-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-Propylpiperidine
CID 31169
4-(Cyclohexylmethyl)piperidine
CID 98883
3-Cyclohexylpiperidine
CID 3809353
Piperidine, 4-(1-methylethyl)-
CID 140569
3-(Propan-2-yl)piperidine
CID 541786
3-Propylpiperidine
CID 114550
3-Cyclobutylpiperidine
CID 54092508
4-Cyclobutylpiperidine
CID 54555009
4-Octylpiperidine hydrochloride
CID 24181035
2-(2-Cyclobutyl-2-cyclohexylethyl)piperidine
CID 137652431
2-(2-Cyclobutyl-2-cyclopentylethyl)piperidine
CID 137661552
4-Cyclohexylpiperidine
CID 424240

Frequently Asked Questions

What is the IUPAC name of 3-(cyclobutylmethyl)-4-methylpiperidine?
The IUPAC name of 3-(cyclobutylmethyl)-4-methylpiperidine (CID 106779274) is 3-(cyclobutylmethyl)-4-methylpiperidine.
What is the SMILES notation for 3-(cyclobutylmethyl)-4-methylpiperidine?
The canonical SMILES for 3-(cyclobutylmethyl)-4-methylpiperidine is CC1CCNCC1CC1CCC1.
What is the InChIKey of 3-(cyclobutylmethyl)-4-methylpiperidine?
The InChIKey is BOUXJDCAUHDRAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9-5-6-12-8-11(9)7-10-3-2-4-10/h9-12H,2-8H2,1H3.
What are the key properties of 3-(cyclobutylmethyl)-4-methylpiperidine?
3-(cyclobutylmethyl)-4-methylpiperidine has a molecular weight of 167.30 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylmethyl)-4-methylpiperidine is sourced from PubChem (CID 106779274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).