N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine

C15H30N2O — CID 55051513

IUPACN-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine
SMILESCCNCC1(CN2CCOC(C)C2)CCCCC1
InChIInChI=1S/C15H30N2O/c1-3-16-12-15(7-5-4-6-8-15)13-17-9-10-18-14(2)11-17/h14,16H,3-13H2,1-2H3
InChIKeyXGHMBVMUPRWNQF-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds5

About N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine

N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine (PubChem CID 55051513) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine
PubChem CID55051513
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine
SMILESCCNCC1(CN2CCOC(C)C2)CCCCC1
InChIInChI=1S/C15H30N2O/c1-3-16-12-15(7-5-4-6-8-15)13-17-9-10-18-14(2)11-17/h14,16H,3-13H2,1-2H3
InChIKeyXGHMBVMUPRWNQF-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine?
The IUPAC name of N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine (CID 55051513) is N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine?
The canonical SMILES for N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine is CCNCC1(CN2CCOC(C)C2)CCCCC1.
What is the InChIKey of N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine?
The InChIKey is XGHMBVMUPRWNQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-16-12-15(7-5-4-6-8-15)13-17-9-10-18-14(2)11-17/h14,16H,3-13H2,1-2H3.
What are the key properties of N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine?
N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(2-methylmorpholin-4-yl)methyl]cyclohexyl]methyl]ethanamine is sourced from PubChem (CID 55051513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).