N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine

C17H37NO2 — CID 63492773

IUPACN-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine
SMILESCCCCCCCCCCCCNCCOCCOC
InChIInChI=1S/C17H37NO2/c1-3-4-5-6-7-8-9-10-11-12-13-18-14-15-20-17-16-19-2/h18H,3-17H2,1-2H3
InChIKeyAAZJCBROIFHGKI-UHFFFAOYSA-N
MW287.49 g/mol
LogP4.16
Rot. Bonds17

About N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine

N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine (PubChem CID 63492773) has the molecular formula C17H37NO2 and a molecular weight of 287.49 g/mol. Its IUPAC name is N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine.

Molecular Properties

Compound NameN-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine
PubChem CID63492773
Molecular FormulaC17H37NO2
Molecular Weight287.49 g/mol
Exact Mass287.28
IUPAC NameN-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine
SMILESCCCCCCCCCCCCNCCOCCOC
InChIInChI=1S/C17H37NO2/c1-3-4-5-6-7-8-9-10-11-12-13-18-14-15-20-17-16-19-2/h18H,3-17H2,1-2H3
InChIKeyAAZJCBROIFHGKI-UHFFFAOYSA-N
XLogP4.16
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.49
LogP ≤ 54.16
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

N-[3-(2-methoxyethoxy)propyl]hexan-1-amine
CID 28880105
N-(2-hexoxyethyl)-3-methoxypropan-1-amine
CID 62599714
N-(2-butoxyethyl)heptan-1-amine
CID 61168932
ethane;N-(2-methoxyethyl)hexan-1-amine
CID 177359501
2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine
CID 130284119
N-(4-methoxybutyl)tetradecan-1-amine
CID 145085752
3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine
CID 104561644
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(hexadecylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 101188232
6-[2-(2-methoxyethoxy)ethylamino]hexan-1-ol
CID 107703333
6-chloro-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]hexan-1-amine
CID 114008238
3-methoxy-N-[2-(2-propoxyethoxy)ethyl]propan-1-amine
CID 63685704
2-[2-(dodecylamino)ethoxy]ethanol
CID 4546884

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine?
The IUPAC name of N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine (CID 63492773) is N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine.
What is the SMILES notation for N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine?
The canonical SMILES for N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine is CCCCCCCCCCCCNCCOCCOC.
What is the InChIKey of N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine?
The InChIKey is AAZJCBROIFHGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37NO2/c1-3-4-5-6-7-8-9-10-11-12-13-18-14-15-20-17-16-19-2/h18H,3-17H2,1-2H3.
What are the key properties of N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine?
N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine has a molecular weight of 287.49 g/mol, XLogP of 4.16, 17 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine is sourced from PubChem (CID 63492773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).