2-propan-2-yloxyethanamine

C5H13NO — CID 533866

IUPAC2-propan-2-yloxyethanamine
SMILESCC(C)OCCN
InChIInChI=1S/C5H13NO/c1-5(2)7-4-3-6/h5H,3-4,6H2,1-2H3
InChIKeyUSECIYVEPXUVHT-UHFFFAOYSA-N
MW103.17 g/mol
LogP0.37
Rot. Bonds3

About 2-propan-2-yloxyethanamine

2-propan-2-yloxyethanamine (PubChem CID 533866) has the molecular formula C5H13NO and a molecular weight of 103.17 g/mol. Its IUPAC name is 2-propan-2-yloxyethanamine.

Molecular Properties

Compound Name2-propan-2-yloxyethanamine
PubChem CID533866
Molecular FormulaC5H13NO
Molecular Weight103.17 g/mol
Exact Mass103.10
IUPAC Name2-propan-2-yloxyethanamine
SMILESCC(C)OCCN
InChIInChI=1S/C5H13NO/c1-5(2)7-4-3-6/h5H,3-4,6H2,1-2H3
InChIKeyUSECIYVEPXUVHT-UHFFFAOYSA-N
XLogP0.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxyethanamine?
The IUPAC name of 2-propan-2-yloxyethanamine (CID 533866) is 2-propan-2-yloxyethanamine.
What is the SMILES notation for 2-propan-2-yloxyethanamine?
The canonical SMILES for 2-propan-2-yloxyethanamine is CC(C)OCCN.
What is the InChIKey of 2-propan-2-yloxyethanamine?
The InChIKey is USECIYVEPXUVHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO/c1-5(2)7-4-3-6/h5H,3-4,6H2,1-2H3.
What are the key properties of 2-propan-2-yloxyethanamine?
2-propan-2-yloxyethanamine has a molecular weight of 103.17 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxyethanamine is sourced from PubChem (CID 533866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).