1-cyclobutyl-4-(4-methylphenyl)piperidine

C16H23N — CID 118136109

IUPAC1-cyclobutyl-4-(4-methylphenyl)piperidine
SMILESCc1ccc(C2CCN(C3CCC3)CC2)cc1
InChIInChI=1S/C16H23N/c1-13-5-7-14(8-6-13)15-9-11-17(12-10-15)16-3-2-4-16/h5-8,15-16H,2-4,9-12H2,1H3
InChIKeyLINQZGBEAUMYAV-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.73
Rot. Bonds2

About 1-cyclobutyl-4-(4-methylphenyl)piperidine

1-cyclobutyl-4-(4-methylphenyl)piperidine (PubChem CID 118136109) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is 1-cyclobutyl-4-(4-methylphenyl)piperidine.

Molecular Properties

Compound Name1-cyclobutyl-4-(4-methylphenyl)piperidine
PubChem CID118136109
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name1-cyclobutyl-4-(4-methylphenyl)piperidine
SMILESCc1ccc(C2CCN(C3CCC3)CC2)cc1
InChIInChI=1S/C16H23N/c1-13-5-7-14(8-6-13)15-9-11-17(12-10-15)16-3-2-4-16/h5-8,15-16H,2-4,9-12H2,1H3
InChIKeyLINQZGBEAUMYAV-UHFFFAOYSA-N
XLogP3.73
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-4-(4-methylphenyl)piperidine?
The IUPAC name of 1-cyclobutyl-4-(4-methylphenyl)piperidine (CID 118136109) is 1-cyclobutyl-4-(4-methylphenyl)piperidine.
What is the SMILES notation for 1-cyclobutyl-4-(4-methylphenyl)piperidine?
The canonical SMILES for 1-cyclobutyl-4-(4-methylphenyl)piperidine is Cc1ccc(C2CCN(C3CCC3)CC2)cc1.
What is the InChIKey of 1-cyclobutyl-4-(4-methylphenyl)piperidine?
The InChIKey is LINQZGBEAUMYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-13-5-7-14(8-6-13)15-9-11-17(12-10-15)16-3-2-4-16/h5-8,15-16H,2-4,9-12H2,1H3.
What are the key properties of 1-cyclobutyl-4-(4-methylphenyl)piperidine?
1-cyclobutyl-4-(4-methylphenyl)piperidine has a molecular weight of 229.37 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-4-(4-methylphenyl)piperidine is sourced from PubChem (CID 118136109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).