1-[methoxy(methyl)amino]ethoxymethanol

C5H13NO3 — CID 22965539

IUPAC1-[methoxy(methyl)amino]ethoxymethanol
SMILESCON(C)C(C)OCO
InChIInChI=1S/C5H13NO3/c1-5(9-4-7)6(2)8-3/h5,7H,4H2,1-3H3
InChIKeyXBTQIMCUSALLPC-UHFFFAOYSA-N
MW135.16 g/mol
LogP-0.21
Rot. Bonds4

About 1-[methoxy(methyl)amino]ethoxymethanol

1-[methoxy(methyl)amino]ethoxymethanol (PubChem CID 22965539) has the molecular formula C5H13NO3 and a molecular weight of 135.16 g/mol. Its IUPAC name is 1-[methoxy(methyl)amino]ethoxymethanol.

Molecular Properties

Compound Name1-[methoxy(methyl)amino]ethoxymethanol
PubChem CID22965539
Molecular FormulaC5H13NO3
Molecular Weight135.16 g/mol
Exact Mass135.09
IUPAC Name1-[methoxy(methyl)amino]ethoxymethanol
SMILESCON(C)C(C)OCO
InChIInChI=1S/C5H13NO3/c1-5(9-4-7)6(2)8-3/h5,7H,4H2,1-3H3
InChIKeyXBTQIMCUSALLPC-UHFFFAOYSA-N
XLogP-0.21
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.16
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[methoxy(methyl)amino]ethoxymethanol?
The IUPAC name of 1-[methoxy(methyl)amino]ethoxymethanol (CID 22965539) is 1-[methoxy(methyl)amino]ethoxymethanol.
What is the SMILES notation for 1-[methoxy(methyl)amino]ethoxymethanol?
The canonical SMILES for 1-[methoxy(methyl)amino]ethoxymethanol is CON(C)C(C)OCO.
What is the InChIKey of 1-[methoxy(methyl)amino]ethoxymethanol?
The InChIKey is XBTQIMCUSALLPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO3/c1-5(9-4-7)6(2)8-3/h5,7H,4H2,1-3H3.
What are the key properties of 1-[methoxy(methyl)amino]ethoxymethanol?
1-[methoxy(methyl)amino]ethoxymethanol has a molecular weight of 135.16 g/mol, XLogP of -0.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methoxy(methyl)amino]ethoxymethanol is sourced from PubChem (CID 22965539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).