N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine

C13H28N2O2 — CID 62575904

IUPACN-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine
SMILESCCCCOCCNCCN1CCOC(C)C1
InChIInChI=1S/C13H28N2O2/c1-3-4-9-16-10-6-14-5-7-15-8-11-17-13(2)12-15/h13-14H,3-12H2,1-2H3
InChIKeyOVWKZKFIWKEJNZ-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.11
Rot. Bonds9

About N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine

N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine (PubChem CID 62575904) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine.

Molecular Properties

Compound NameN-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine
PubChem CID62575904
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC NameN-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine
SMILESCCCCOCCNCCN1CCOC(C)C1
InChIInChI=1S/C13H28N2O2/c1-3-4-9-16-10-6-14-5-7-15-8-11-17-13(2)12-15/h13-14H,3-12H2,1-2H3
InChIKeyOVWKZKFIWKEJNZ-UHFFFAOYSA-N
XLogP1.11
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-butoxyethyl)-2-(2,6-dimethylmorpholin-4-yl)ethanamine
CID 62574260
N-(2-butoxyethyl)-2-(3,4-dimethylpiperazin-1-yl)ethanamine
CID 55216424
N-(2-butoxyethyl)-2-(3-ethyl-4-methylpiperazin-1-yl)ethanamine
CID 63621704
N-(2-butoxyethyl)-2-(5-ethyl-2-methylmorpholin-4-yl)ethanamine
CID 62558581
N-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]hexan-1-amine
CID 62967255
N-(2-butoxyethyl)-2-(4-ethylpiperazin-1-yl)ethanamine
CID 62574670
N-(2-ethoxyethyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 62561352
azane;4-dodecyl-2-methylmorpholine;hydrobromide
CID 174921468
N-(2-butoxyethyl)-2-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)ethanamine
CID 81194356
N-methylformamide;2-methyl-4-[2-(4-methylpentoxy)ethyl]morpholine;2-methylpropane
CID 155582545
N-(2-butoxyethyl)-2-(1-oxo-1,4-thiazinan-4-yl)ethanamine
CID 62554738
acetic acid;4-butyl-2-methylmorpholine
CID 175198746

Frequently Asked Questions

What is the IUPAC name of N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine?
The IUPAC name of N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine (CID 62575904) is N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine.
What is the SMILES notation for N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine?
The canonical SMILES for N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine is CCCCOCCNCCN1CCOC(C)C1.
What is the InChIKey of N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine?
The InChIKey is OVWKZKFIWKEJNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-3-4-9-16-10-6-14-5-7-15-8-11-17-13(2)12-15/h13-14H,3-12H2,1-2H3.
What are the key properties of N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine?
N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine has a molecular weight of 244.38 g/mol, XLogP of 1.11, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine is sourced from PubChem (CID 62575904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).