2-(3-aminobutan-2-yloxy)ethanol

C6H15NO2 — CID 142952551

IUPAC2-(3-aminobutan-2-yloxy)ethanol
SMILESCC(N)C(C)OCCO
InChIInChI=1S/C6H15NO2/c1-5(7)6(2)9-4-3-8/h5-6,8H,3-4,7H2,1-2H3
InChIKeyYWZORFHJVFPQLY-UHFFFAOYSA-N
MW133.19 g/mol
LogP-0.27
Rot. Bonds4

About 2-(3-aminobutan-2-yloxy)ethanol

2-(3-aminobutan-2-yloxy)ethanol (PubChem CID 142952551) has the molecular formula C6H15NO2 and a molecular weight of 133.19 g/mol. Its IUPAC name is 2-(3-aminobutan-2-yloxy)ethanol.

Molecular Properties

Compound Name2-(3-aminobutan-2-yloxy)ethanol
PubChem CID142952551
Molecular FormulaC6H15NO2
Molecular Weight133.19 g/mol
Exact Mass133.11
IUPAC Name2-(3-aminobutan-2-yloxy)ethanol
SMILESCC(N)C(C)OCCO
InChIInChI=1S/C6H15NO2/c1-5(7)6(2)9-4-3-8/h5-6,8H,3-4,7H2,1-2H3
InChIKeyYWZORFHJVFPQLY-UHFFFAOYSA-N
XLogP-0.27
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminobutan-2-yloxy)ethanol?
The IUPAC name of 2-(3-aminobutan-2-yloxy)ethanol (CID 142952551) is 2-(3-aminobutan-2-yloxy)ethanol.
What is the SMILES notation for 2-(3-aminobutan-2-yloxy)ethanol?
The canonical SMILES for 2-(3-aminobutan-2-yloxy)ethanol is CC(N)C(C)OCCO.
What is the InChIKey of 2-(3-aminobutan-2-yloxy)ethanol?
The InChIKey is YWZORFHJVFPQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2/c1-5(7)6(2)9-4-3-8/h5-6,8H,3-4,7H2,1-2H3.
What are the key properties of 2-(3-aminobutan-2-yloxy)ethanol?
2-(3-aminobutan-2-yloxy)ethanol has a molecular weight of 133.19 g/mol, XLogP of -0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminobutan-2-yloxy)ethanol is sourced from PubChem (CID 142952551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).