2-amino-2,2-dideuterioethanol

C2H7NO — CID 13000292

IUPAC2-amino-2,2-dideuterioethanol
SMILES[2H]C([2H])(N)CO
InChIInChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2/i1D2
InChIKeyHZAXFHJVJLSVMW-DICFDUPASA-N
MW63.10 g/mol
LogP-1.06
Rot. Bonds1

About 2-amino-2,2-dideuterioethanol

2-amino-2,2-dideuterioethanol (PubChem CID 13000292) has the molecular formula C2H7NO and a molecular weight of 63.10 g/mol. Its IUPAC name is 2-amino-2,2-dideuterioethanol.

Molecular Properties

Compound Name2-amino-2,2-dideuterioethanol
PubChem CID13000292
Molecular FormulaC2H7NO
Molecular Weight63.10 g/mol
Exact Mass63.07
IUPAC Name2-amino-2,2-dideuterioethanol
SMILES[2H]C([2H])(N)CO
InChIInChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2/i1D2
InChIKeyHZAXFHJVJLSVMW-DICFDUPASA-N
XLogP-1.06
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50063.10
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2,2-dideuterioethanol?
The IUPAC name of 2-amino-2,2-dideuterioethanol (CID 13000292) is 2-amino-2,2-dideuterioethanol.
What is the SMILES notation for 2-amino-2,2-dideuterioethanol?
The canonical SMILES for 2-amino-2,2-dideuterioethanol is [2H]C([2H])(N)CO.
What is the InChIKey of 2-amino-2,2-dideuterioethanol?
The InChIKey is HZAXFHJVJLSVMW-DICFDUPASA-N. The full InChI is InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2/i1D2.
What are the key properties of 2-amino-2,2-dideuterioethanol?
2-amino-2,2-dideuterioethanol has a molecular weight of 63.10 g/mol, XLogP of -1.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2,2-dideuterioethanol is sourced from PubChem (CID 13000292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).