2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane

C14H33NO4 — CID 170966597

IUPAC2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane
SMILESCCCCC.COCCOCCOCCOCCN
InChIInChI=1S/C9H21NO4.C5H12/c1-11-4-5-13-8-9-14-7-6-12-3-2-10;1-3-5-4-2/h2-10H2,1H3;3-5H2,1-2H3
InChIKeyYOHOESNTGGIANB-UHFFFAOYSA-N
MW279.42 g/mol
LogP1.84
Rot. Bonds13

About 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane

2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane (PubChem CID 170966597) has the molecular formula C14H33NO4 and a molecular weight of 279.42 g/mol. Its IUPAC name is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane.

Molecular Properties

Compound Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane
PubChem CID170966597
Molecular FormulaC14H33NO4
Molecular Weight279.42 g/mol
Exact Mass279.24
IUPAC Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane
SMILESCCCCC.COCCOCCOCCOCCN
InChIInChI=1S/C9H21NO4.C5H12/c1-11-4-5-13-8-9-14-7-6-12-3-2-10;1-3-5-4-2/h2-10H2,1H3;3-5H2,1-2H3
InChIKeyYOHOESNTGGIANB-UHFFFAOYSA-N
XLogP1.84
TPSA62.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.42
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 18764651
2-[2-[3-[2-(2-methoxyethoxy)ethoxy]propoxy]ethoxy]ethanamine
CID 146320426
2-[2-[3-(2-methoxyethoxy)propoxy]ethoxy]ethanamine
CID 103482612
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;hydrochloride
CID 146502612
methanamine;2-(2-methoxyethoxy)ethanamine
CID 145171254
2-[2-(3-methoxypropoxy)ethoxy]ethanamine
CID 103175799
O-hexan-2-ylhydroxylamine;2-(2-methoxyethoxy)ethanamine
CID 89466317
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-octadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 86291503
2-[2-(2-octadecoxyethoxy)ethoxy]ethanamine
CID 139597829
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 139598207
2-(2-methoxyethoxymethoxy)ethanamine
CID 19350391
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane
CID 44593867

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane?
The IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane (CID 170966597) is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane.
What is the SMILES notation for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane?
The canonical SMILES for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane is CCCCC.COCCOCCOCCOCCN.
What is the InChIKey of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane?
The InChIKey is YOHOESNTGGIANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO4.C5H12/c1-11-4-5-13-8-9-14-7-6-12-3-2-10;1-3-5-4-2/h2-10H2,1H3;3-5H2,1-2H3.
What are the key properties of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane?
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane has a molecular weight of 279.42 g/mol, XLogP of 1.84, 13 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine;pentane is sourced from PubChem (CID 170966597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).