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

C16H32N2O — CID 104678777

IUPAC[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine
SMILESCCC1COC(C)CN1CCC1(CN)CCCCC1
InChIInChI=1S/C16H32N2O/c1-3-15-12-19-14(2)11-18(15)10-9-16(13-17)7-5-4-6-8-16/h14-15H,3-13,17H2,1-2H3
InChIKeyLLFGBKJQWKZAEI-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.79
Rot. Bonds5

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

[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine (PubChem CID 104678777) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine
PubChem CID104678777
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine
SMILESCCC1COC(C)CN1CCC1(CN)CCCCC1
InChIInChI=1S/C16H32N2O/c1-3-15-12-19-14(2)11-18(15)10-9-16(13-17)7-5-4-6-8-16/h14-15H,3-13,17H2,1-2H3
InChIKeyLLFGBKJQWKZAEI-UHFFFAOYSA-N
XLogP2.79
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.79
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]cyclohexyl]methanamine?
The IUPAC name of [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine (CID 104678777) is [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine.
What is the SMILES notation for [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine?
The canonical SMILES for [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine is CCC1COC(C)CN1CCC1(CN)CCCCC1.
What is the InChIKey of [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine?
The InChIKey is LLFGBKJQWKZAEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-15-12-19-14(2)11-18(15)10-9-16(13-17)7-5-4-6-8-16/h14-15H,3-13,17H2,1-2H3.
What are the key properties of [1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine?
[1-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]cyclohexyl]methanamine has a molecular weight of 268.44 g/mol, XLogP of 2.79, 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]cyclohexyl]methanamine is sourced from PubChem (CID 104678777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).