2-[2-(oxolan-3-yloxy)ethoxy]ethanamine

C8H17NO3 — CID 103482534

IUPAC2-[2-(oxolan-3-yloxy)ethoxy]ethanamine
SMILESNCCOCCOC1CCOC1
InChIInChI=1S/C8H17NO3/c9-2-4-10-5-6-12-8-1-3-11-7-8/h8H,1-7,9H2
InChIKeyITJDMWQTUIBRQK-UHFFFAOYSA-N
MW175.23 g/mol
LogP-0.23
Rot. Bonds6

About 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine

2-[2-(oxolan-3-yloxy)ethoxy]ethanamine (PubChem CID 103482534) has the molecular formula C8H17NO3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine.

Molecular Properties

Compound Name2-[2-(oxolan-3-yloxy)ethoxy]ethanamine
PubChem CID103482534
Molecular FormulaC8H17NO3
Molecular Weight175.23 g/mol
Exact Mass175.12
IUPAC Name2-[2-(oxolan-3-yloxy)ethoxy]ethanamine
SMILESNCCOCCOC1CCOC1
InChIInChI=1S/C8H17NO3/c9-2-4-10-5-6-12-8-1-3-11-7-8/h8H,1-7,9H2
InChIKeyITJDMWQTUIBRQK-UHFFFAOYSA-N
XLogP-0.23
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(3-Aminopropoxy)oxolane
CID 63558018
rac-(3R,4S)-4-methoxyoxolan-3-amine
CID 54857357
2-(Oxolan-3-yloxy)ethan-1-amine
CID 63557219
3-(2-Aminopropoxy)oxolane
CID 63558631
(3S,4R)-4-Methoxytetrahydrofuran-3-amine
CID 29893135
(2S)-2-[2-(2-methoxyethoxy)ethoxy]propan-1-amine
CID 102416894
3,3,3-Trifluoro-2-(oxolan-3-yloxy)propan-1-amine
CID 63559228
2-[2,3-Bis(2-aminoethoxy)propoxy]ethanamine
CID 18346266
8Arm-peg-NH2
CID 21349194
4-Methoxyoxolan-3-amine
CID 53276290
4-Ethoxyoxolan-3-amine
CID 53398901
4-Methoxy-2-(2-methoxyethoxy)butan-1-amine
CID 57100761

Frequently Asked Questions

What is the IUPAC name of 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine?
The IUPAC name of 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine (CID 103482534) is 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine.
What is the SMILES notation for 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine?
The canonical SMILES for 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine is NCCOCCOC1CCOC1.
What is the InChIKey of 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine?
The InChIKey is ITJDMWQTUIBRQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO3/c9-2-4-10-5-6-12-8-1-3-11-7-8/h8H,1-7,9H2.
What are the key properties of 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine?
2-[2-(oxolan-3-yloxy)ethoxy]ethanamine has a molecular weight of 175.23 g/mol, XLogP of -0.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(oxolan-3-yloxy)ethoxy]ethanamine is sourced from PubChem (CID 103482534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).