methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde

C8H19NO4 — CID 143805512

IUPACmethanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde
SMILESCO.COCCOCCNCC=O
InChIInChI=1S/C7H15NO3.CH4O/c1-10-6-7-11-5-3-8-2-4-9;1-2/h4,8H,2-3,5-7H2,1H3;2H,1H3
InChIKeyAUTOMPYSKWHZNP-UHFFFAOYSA-N
MW193.24 g/mol
LogP-0.95
Rot. Bonds8

About methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde

methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde (PubChem CID 143805512) has the molecular formula C8H19NO4 and a molecular weight of 193.24 g/mol. Its IUPAC name is methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde.

Molecular Properties

Compound Namemethanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde
PubChem CID143805512
Molecular FormulaC8H19NO4
Molecular Weight193.24 g/mol
Exact Mass193.13
IUPAC Namemethanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde
SMILESCO.COCCOCCNCC=O
InChIInChI=1S/C7H15NO3.CH4O/c1-10-6-7-11-5-3-8-2-4-9;1-2/h4,8H,2-3,5-7H2,1H3;2H,1H3
InChIKeyAUTOMPYSKWHZNP-UHFFFAOYSA-N
XLogP-0.95
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.24
LogP ≤ 5-0.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethylamino)acetaldehyde
CID 54243184
2-[2-(2-methoxyethoxy)ethylamino]acetic acid
CID 58383949
bis(1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane);2-methoxy-N-(2-methoxyethyl)ethanamine
CID 87204076
2-methoxy-N-[2-[2-[2-[2-[2-(2-methoxyethylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]ethanamine
CID 102574909
N-[2-[2-(2-oxoethylamino)ethoxy]ethyl]formamide
CID 156882800
N-[2-(3-methoxypropoxy)ethyl]prop-2-en-1-amine
CID 62566842
3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine
CID 104561644
2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine
CID 130284119
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide
CID 162740366
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]hydroxylamine
CID 144965473
2-[2-(2-methoxyethoxy)ethoxy]acetaldehyde
CID 10607071
N-(2-chloroethyl)-2-[2-(2-methoxyethoxy)ethoxy]ethanamine
CID 104567151

Frequently Asked Questions

What is the IUPAC name of methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde?
The IUPAC name of methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde (CID 143805512) is methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde.
What is the SMILES notation for methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde?
The canonical SMILES for methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde is CO.COCCOCCNCC=O.
What is the InChIKey of methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde?
The InChIKey is AUTOMPYSKWHZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3.CH4O/c1-10-6-7-11-5-3-8-2-4-9;1-2/h4,8H,2-3,5-7H2,1H3;2H,1H3.
What are the key properties of methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde?
methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde has a molecular weight of 193.24 g/mol, XLogP of -0.95, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;2-[2-(2-methoxyethoxy)ethylamino]acetaldehyde is sourced from PubChem (CID 143805512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).