2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol

C8H19NO4 — CID 112704571

IUPAC2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol
SMILESCOCCOCCOCC(N)CO
InChIInChI=1S/C8H19NO4/c1-11-2-3-12-4-5-13-7-8(9)6-10/h8,10H,2-7,9H2,1H3
InChIKeyGXYTVPCBNNWHOU-UHFFFAOYSA-N
MW193.24 g/mol
LogP-1.01
Rot. Bonds9

About 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol

2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol (PubChem CID 112704571) has the molecular formula C8H19NO4 and a molecular weight of 193.24 g/mol. Its IUPAC name is 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol.

Molecular Properties

Compound Name2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol
PubChem CID112704571
Molecular FormulaC8H19NO4
Molecular Weight193.24 g/mol
Exact Mass193.13
IUPAC Name2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol
SMILESCOCCOCCOCC(N)CO
InChIInChI=1S/C8H19NO4/c1-11-2-3-12-4-5-13-7-8(9)6-10/h8,10H,2-7,9H2,1H3
InChIKeyGXYTVPCBNNWHOU-UHFFFAOYSA-N
XLogP-1.01
TPSA73.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.24
LogP ≤ 5-1.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-3-[2-(3-methoxypropoxy)ethoxy]propan-1-ol
CID 103181539
2-amino-4-[2-(2-methoxyethoxy)ethoxy]butan-1-ol
CID 104567674
2-amino-3-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]propan-1-ol
CID 104567836
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane-1,2-diol
CID 88556608
(2S)-1-[2-(2-methoxyethoxy)ethoxy]propan-2-amine
CID 104560725
(2S)-2-amino-3-butoxypropan-1-ol
CID 89011091
2-amino-3-(3-hydroxypropoxy)propan-1-ol
CID 130579095
(3S)-3-amino-4-[2-(2-methoxyethoxy)ethoxy]butan-2-one
CID 59672514
(2R)-4-[(2R)-2-amino-3-hydroxypropoxy]butan-2-ol
CID 59968163
3-amino-4-methoxy-2-[2-(2-methoxyethoxy)ethoxy]butan-1-ol
CID 114358390
1-methoxy-2-(2-methoxyethoxy)ethane;propane-1,2,3-triol
CID 162081767
2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane-1,1-diol
CID 87208063

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol?
The IUPAC name of 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol (CID 112704571) is 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol.
What is the SMILES notation for 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol?
The canonical SMILES for 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol is COCCOCCOCC(N)CO.
What is the InChIKey of 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol?
The InChIKey is GXYTVPCBNNWHOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO4/c1-11-2-3-12-4-5-13-7-8(9)6-10/h8,10H,2-7,9H2,1H3.
What are the key properties of 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol?
2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol has a molecular weight of 193.24 g/mol, XLogP of -1.01, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol is sourced from PubChem (CID 112704571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).