2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine

C14H28N2 — CID 115211477

IUPAC2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine
SMILESCN(CCC1CCC1)CCC1CCCNC1
InChIInChI=1S/C14H28N2/c1-16(10-7-13-4-2-5-13)11-8-14-6-3-9-15-12-14/h13-15H,2-12H2,1H3
InChIKeySTVXXBWISZZEBQ-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.50
Rot. Bonds6

About 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine

2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine (PubChem CID 115211477) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine.

Molecular Properties

Compound Name2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine
PubChem CID115211477
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine
SMILESCN(CCC1CCC1)CCC1CCCNC1
InChIInChI=1S/C14H28N2/c1-16(10-7-13-4-2-5-13)11-8-14-6-3-9-15-12-14/h13-15H,2-12H2,1H3
InChIKeySTVXXBWISZZEBQ-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine?
The IUPAC name of 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine (CID 115211477) is 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine.
What is the SMILES notation for 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine?
The canonical SMILES for 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine is CN(CCC1CCC1)CCC1CCCNC1.
What is the InChIKey of 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine?
The InChIKey is STVXXBWISZZEBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-16(10-7-13-4-2-5-13)11-8-14-6-3-9-15-12-14/h13-15H,2-12H2,1H3.
What are the key properties of 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine?
2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine has a molecular weight of 224.39 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine is sourced from PubChem (CID 115211477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).