(deuterioamino)oxyethane

C2H7NO — CID 59117090

IUPAC(deuterioamino)oxyethane
SMILES[2H]NOCC
InChIInChI=1S/C2H7NO/c1-2-4-3/h2-3H2,1H3/i3D
InChIKeyAQFWNELGMODZGC-WFVSFCRTSA-N
MW62.09 g/mol
LogP-0.10
Rot. Bonds2

About (deuterioamino)oxyethane

(deuterioamino)oxyethane (PubChem CID 59117090) has the molecular formula C2H7NO and a molecular weight of 62.09 g/mol. Its IUPAC name is (deuterioamino)oxyethane.

Molecular Properties

Compound Name(deuterioamino)oxyethane
PubChem CID59117090
Molecular FormulaC2H7NO
Molecular Weight62.09 g/mol
Exact Mass62.06
IUPAC Name(deuterioamino)oxyethane
SMILES[2H]NOCC
InChIInChI=1S/C2H7NO/c1-2-4-3/h2-3H2,1H3/i3D
InChIKeyAQFWNELGMODZGC-WFVSFCRTSA-N
XLogP-0.10
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50062.09
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (deuterioamino)oxyethane?
The IUPAC name of (deuterioamino)oxyethane (CID 59117090) is (deuterioamino)oxyethane.
What is the SMILES notation for (deuterioamino)oxyethane?
The canonical SMILES for (deuterioamino)oxyethane is [2H]NOCC.
What is the InChIKey of (deuterioamino)oxyethane?
The InChIKey is AQFWNELGMODZGC-WFVSFCRTSA-N. The full InChI is InChI=1S/C2H7NO/c1-2-4-3/h2-3H2,1H3/i3D.
What are the key properties of (deuterioamino)oxyethane?
(deuterioamino)oxyethane has a molecular weight of 62.09 g/mol, XLogP of -0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (deuterioamino)oxyethane is sourced from PubChem (CID 59117090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).