[1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine

C14H28N2O — CID 81169483

IUPAC[1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine
SMILESCCOC1CCN(CCC2(CN)CCC2)CC1
InChIInChI=1S/C14H28N2O/c1-2-17-13-4-9-16(10-5-13)11-8-14(12-15)6-3-7-14/h13H,2-12,15H2,1H3
InChIKeyLGAXQJFZCQSCQI-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.01
Rot. Bonds6

About [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine

[1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine (PubChem CID 81169483) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine
PubChem CID81169483
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine
SMILESCCOC1CCN(CCC2(CN)CCC2)CC1
InChIInChI=1S/C14H28N2O/c1-2-17-13-4-9-16(10-5-13)11-8-14(12-15)6-3-7-14/h13H,2-12,15H2,1H3
InChIKeyLGAXQJFZCQSCQI-UHFFFAOYSA-N
XLogP2.01
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine?
The IUPAC name of [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine (CID 81169483) is [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine.
What is the SMILES notation for [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine?
The canonical SMILES for [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine is CCOC1CCN(CCC2(CN)CCC2)CC1.
What is the InChIKey of [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine?
The InChIKey is LGAXQJFZCQSCQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-2-17-13-4-9-16(10-5-13)11-8-14(12-15)6-3-7-14/h13H,2-12,15H2,1H3.
What are the key properties of [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine?
[1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine has a molecular weight of 240.39 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(4-ethoxypiperidin-1-yl)ethyl]cyclobutyl]methanamine is sourced from PubChem (CID 81169483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).