2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine

C14H31NO2 — CID 62597434

IUPAC2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine
SMILESCCCCC(CC)COCCNCCOCC
InChIInChI=1S/C14H31NO2/c1-4-7-8-14(5-2)13-17-12-10-15-9-11-16-6-3/h14-15H,4-13H2,1-3H3
InChIKeyKUXMVBHAAUHNGG-UHFFFAOYSA-N
MW245.41 g/mol
LogP2.85
Rot. Bonds13

About 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine

2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine (PubChem CID 62597434) has the molecular formula C14H31NO2 and a molecular weight of 245.41 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine
PubChem CID62597434
Molecular FormulaC14H31NO2
Molecular Weight245.41 g/mol
Exact Mass245.24
IUPAC Name2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine
SMILESCCCCC(CC)COCCNCCOCC
InChIInChI=1S/C14H31NO2/c1-4-7-8-14(5-2)13-17-12-10-15-9-11-16-6-3/h14-15H,4-13H2,1-3H3
InChIKeyKUXMVBHAAUHNGG-UHFFFAOYSA-N
XLogP2.85
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(2S)-2-ethylhexoxy]-N-[2-[(2R)-2-ethylhexoxy]ethyl]ethanamine
CID 27255212
N-[2-(2-ethylhexoxy)ethyl]-3,3-dimethylbutan-1-amine
CID 55196096
(3R)-3-[[(2R)-2-ethylhexoxy]methyl]heptane
CID 91827254
3-[2-(2-methylhexoxy)ethoxymethyl]octane
CID 171470353
3-(2-ethylhexoxymethyl)heptane;titanium
CID 87161815
(3S)-3-(2-chloroethoxymethyl)heptane
CID 40579971
2-ethylhexoxymethanol
CID 18783221
1-[4-[2-[2-(2-ethylhexoxy)ethoxy]ethoxy]butoxy]dodecane
CID 129302674
2-[(2S)-2-ethylhexoxy]-N,N-bis[2-[(2S)-2-ethylhexoxy]ethyl]ethanamine
CID 97464992
3-[2-(2-chloroethoxy)ethoxymethyl]heptane
CID 63664806
tris[3-(2-ethylhexoxy)propyl]azanium
CID 173204281
2-[2-[2-[2-[2-(2-ethylhexoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 86129872

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine?
The IUPAC name of 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine (CID 62597434) is 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine.
What is the SMILES notation for 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine?
The canonical SMILES for 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine is CCCCC(CC)COCCNCCOCC.
What is the InChIKey of 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine?
The InChIKey is KUXMVBHAAUHNGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO2/c1-4-7-8-14(5-2)13-17-12-10-15-9-11-16-6-3/h14-15H,4-13H2,1-3H3.
What are the key properties of 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine?
2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine has a molecular weight of 245.41 g/mol, XLogP of 2.85, 13 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(2-ethylhexoxy)ethyl]ethanamine is sourced from PubChem (CID 62597434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).