2-nonoxy-N-(2-nonoxyethyl)ethanamine

C22H47NO2 — CID 14205552

IUPAC2-nonoxy-N-(2-nonoxyethyl)ethanamine
SMILESCCCCCCCCCOCCNCCOCCCCCCCCC
InChIInChI=1S/C22H47NO2/c1-3-5-7-9-11-13-15-19-24-21-17-23-18-22-25-20-16-14-12-10-8-6-4-2/h23H,3-22H2,1-2H3
InChIKeyCNUMXOFTCYIKJW-UHFFFAOYSA-N
MW357.62 g/mol
LogP6.11
Rot. Bonds22

About 2-nonoxy-N-(2-nonoxyethyl)ethanamine

2-nonoxy-N-(2-nonoxyethyl)ethanamine (PubChem CID 14205552) has the molecular formula C22H47NO2 and a molecular weight of 357.62 g/mol. Its IUPAC name is 2-nonoxy-N-(2-nonoxyethyl)ethanamine.

Molecular Properties

Compound Name2-nonoxy-N-(2-nonoxyethyl)ethanamine
PubChem CID14205552
Molecular FormulaC22H47NO2
Molecular Weight357.62 g/mol
Exact Mass357.36
IUPAC Name2-nonoxy-N-(2-nonoxyethyl)ethanamine
SMILESCCCCCCCCCOCCNCCOCCCCCCCCC
InChIInChI=1S/C22H47NO2/c1-3-5-7-9-11-13-15-19-24-21-17-23-18-22-25-20-16-14-12-10-8-6-4-2/h23H,3-22H2,1-2H3
InChIKeyCNUMXOFTCYIKJW-UHFFFAOYSA-N
XLogP6.11
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds22
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.62
LogP ≤ 56.11
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-(2-(Dodecyloxy)-ethoxy)-ethylamine
CID 4425284
3-[2-[2-(3-Aminopropoxy)ethyl-(2-cyclododecyloxyethyl)amino]ethoxy]propan-1-amine
CID 15664447
2-Hexadecoxyethanamine
CID 17914362
2-Tetradecoxyethanamine
CID 18672783
Bis-(2-decyloxy-ethyl)-amine
CID 6421831
13,22-Diaza-7,10,16,19,25,28-hexaoxatetratriacontane
CID 630498
Bis(2-octyloxyethyl)amine
CID 14205548
Bis(2-hexyloxyethyl)amine
CID 37981521
Bis-(2-lauroxyethyl)amine
CID 54064228
2-tetradecoxy-N-(2-tetradecoxyethyl)ethanamine
CID 88888821
2-hexadecoxy-N-(2-hexadecoxyethyl)ethanamine
CID 89427424
2-Octadecoxyethanamine
CID 18672810

Frequently Asked Questions

What is the IUPAC name of 2-nonoxy-N-(2-nonoxyethyl)ethanamine?
The IUPAC name of 2-nonoxy-N-(2-nonoxyethyl)ethanamine (CID 14205552) is 2-nonoxy-N-(2-nonoxyethyl)ethanamine.
What is the SMILES notation for 2-nonoxy-N-(2-nonoxyethyl)ethanamine?
The canonical SMILES for 2-nonoxy-N-(2-nonoxyethyl)ethanamine is CCCCCCCCCOCCNCCOCCCCCCCCC.
What is the InChIKey of 2-nonoxy-N-(2-nonoxyethyl)ethanamine?
The InChIKey is CNUMXOFTCYIKJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H47NO2/c1-3-5-7-9-11-13-15-19-24-21-17-23-18-22-25-20-16-14-12-10-8-6-4-2/h23H,3-22H2,1-2H3.
What are the key properties of 2-nonoxy-N-(2-nonoxyethyl)ethanamine?
2-nonoxy-N-(2-nonoxyethyl)ethanamine has a molecular weight of 357.62 g/mol, XLogP of 6.11, 22 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-nonoxy-N-(2-nonoxyethyl)ethanamine is sourced from PubChem (CID 14205552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).