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

C9H21NO2 — CID 103482563

IUPAC2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine
SMILESCC(C)C(C)OCCOCCN
InChIInChI=1S/C9H21NO2/c1-8(2)9(3)12-7-6-11-5-4-10/h8-9H,4-7,10H2,1-3H3
InChIKeyPPCLITABZCGSIM-UHFFFAOYSA-N
MW175.27 g/mol
LogP1.02
Rot. Bonds7

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

2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine (PubChem CID 103482563) has the molecular formula C9H21NO2 and a molecular weight of 175.27 g/mol. Its IUPAC name is 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine.

Molecular Properties

Compound Name2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine
PubChem CID103482563
Molecular FormulaC9H21NO2
Molecular Weight175.27 g/mol
Exact Mass175.16
IUPAC Name2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine
SMILESCC(C)C(C)OCCOCCN
InChIInChI=1S/C9H21NO2/c1-8(2)9(3)12-7-6-11-5-4-10/h8-9H,4-7,10H2,1-3H3
InChIKeyPPCLITABZCGSIM-UHFFFAOYSA-N
XLogP1.02
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 51.02
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-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol
CID 139963056
2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanol
CID 87592876
2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;azane
CID 174533279
1-[2-(2-aminoethoxy)ethoxy]-3-methylbutan-2-ol
CID 144781174
2-(2-aminoethoxy)ethanamine;azane
CID 87273439
2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 18764651
(2S)-2-[2-(2-methoxyethoxy)ethoxy]propan-1-amine
CID 102416894
N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]propan-2-amine
CID 138744855
2-(2-propoxyethoxy)propan-1-amine
CID 63686172
2-[2-[2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 87184275
3-(2-butan-2-yloxyethoxy)propan-1-amine
CID 88947745
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

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine?
The IUPAC name of 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine (CID 103482563) is 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine.
What is the SMILES notation for 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine?
The canonical SMILES for 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine is CC(C)C(C)OCCOCCN.
What is the InChIKey of 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine?
The InChIKey is PPCLITABZCGSIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO2/c1-8(2)9(3)12-7-6-11-5-4-10/h8-9H,4-7,10H2,1-3H3.
What are the key properties of 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine?
2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine has a molecular weight of 175.27 g/mol, XLogP of 1.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine is sourced from PubChem (CID 103482563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).