4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine

C10H24N2O3 — CID 22901826

IUPAC4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine
SMILESNCCCCOCCOCCOCCN
InChIInChI=1S/C10H24N2O3/c11-3-1-2-5-13-7-9-15-10-8-14-6-4-12/h1-12H2
InChIKeyYXKFJQXTGZBLSR-UHFFFAOYSA-N
MW220.31 g/mol
LogP-0.27
Rot. Bonds12

About 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine

4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine (PubChem CID 22901826) has the molecular formula C10H24N2O3 and a molecular weight of 220.31 g/mol. Its IUPAC name is 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine.

Molecular Properties

Compound Name4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine
PubChem CID22901826
Molecular FormulaC10H24N2O3
Molecular Weight220.31 g/mol
Exact Mass220.18
IUPAC Name4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine
SMILESNCCCCOCCOCCOCCN
InChIInChI=1S/C10H24N2O3/c11-3-1-2-5-13-7-9-15-10-8-14-6-4-12/h1-12H2
InChIKeyYXKFJQXTGZBLSR-UHFFFAOYSA-N
XLogP-0.27
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-(2-aminoethoxy)pentan-1-amine
CID 58473832
4-[2-(4-aminobutoxy)ethoxy]butan-1-amine
CID 87873641
4-(2-aminoethoxy)butan-1-amine;ethane
CID 171066196
6-[2-(3-aminopropoxy)ethoxy]hexan-1-amine
CID 87252227
11-(11-aminoundecoxy)undecan-1-amine
CID 19099845
3-[3-[2-(3-aminopropoxy)ethoxy]propoxy]propan-1-amine
CID 118897120
2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;azane
CID 174533279
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-[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
6-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]hexan-1-amine
CID 104566998
6-[2-(2-methoxyethoxy)ethoxy]hexan-1-amine
CID 104566819

Frequently Asked Questions

What is the IUPAC name of 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine?
The IUPAC name of 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine (CID 22901826) is 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine.
What is the SMILES notation for 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine?
The canonical SMILES for 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine is NCCCCOCCOCCOCCN.
What is the InChIKey of 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine?
The InChIKey is YXKFJQXTGZBLSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3/c11-3-1-2-5-13-7-9-15-10-8-14-6-4-12/h1-12H2.
What are the key properties of 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine?
4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine has a molecular weight of 220.31 g/mol, XLogP of -0.27, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine is sourced from PubChem (CID 22901826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).