[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine

C14H28N2O — CID 81170463

IUPAC[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine
SMILESCCC1COC(C)CN1CCC1(CN)CCC1
InChIInChI=1S/C14H28N2O/c1-3-13-10-17-12(2)9-16(13)8-7-14(11-15)5-4-6-14/h12-13H,3-11,15H2,1-2H3
InChIKeyOSKIVDKZVQAZEX-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.00
Rot. Bonds5

About [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine

[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine (PubChem CID 81170463) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine
PubChem CID81170463
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine
SMILESCCC1COC(C)CN1CCC1(CN)CCC1
InChIInChI=1S/C14H28N2O/c1-3-13-10-17-12(2)9-16(13)8-7-14(11-15)5-4-6-14/h12-13H,3-11,15H2,1-2H3
InChIKeyOSKIVDKZVQAZEX-UHFFFAOYSA-N
XLogP2.00
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine?
The IUPAC name of [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine (CID 81170463) is [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine.
What is the SMILES notation for [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine?
The canonical SMILES for [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine is CCC1COC(C)CN1CCC1(CN)CCC1.
What is the InChIKey of [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine?
The InChIKey is OSKIVDKZVQAZEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-13-10-17-12(2)9-16(13)8-7-14(11-15)5-4-6-14/h12-13H,3-11,15H2,1-2H3.
What are the key properties of [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine?
[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine has a molecular weight of 240.39 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclobutyl]methanamine is sourced from PubChem (CID 81170463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).