2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol

C9H19NO3 — CID 62773174

IUPAC2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol
SMILESCOCCNCC(O)C1CCOC1
InChIInChI=1S/C9H19NO3/c1-12-5-3-10-6-9(11)8-2-4-13-7-8/h8-11H,2-7H2,1H3
InChIKeyMTVAKKUGBBTDRT-UHFFFAOYSA-N
MW189.25 g/mol
LogP-0.38
Rot. Bonds6

About 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol

2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol (PubChem CID 62773174) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol
PubChem CID62773174
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC Name2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol
SMILESCOCCNCC(O)C1CCOC1
InChIInChI=1S/C9H19NO3/c1-12-5-3-10-6-9(11)8-2-4-13-7-8/h8-11H,2-7H2,1H3
InChIKeyMTVAKKUGBBTDRT-UHFFFAOYSA-N
XLogP-0.38
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol?
The IUPAC name of 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol (CID 62773174) is 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol.
What is the SMILES notation for 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol?
The canonical SMILES for 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol is COCCNCC(O)C1CCOC1.
What is the InChIKey of 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol?
The InChIKey is MTVAKKUGBBTDRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3/c1-12-5-3-10-6-9(11)8-2-4-13-7-8/h8-11H,2-7H2,1H3.
What are the key properties of 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol?
2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol has a molecular weight of 189.25 g/mol, XLogP of -0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol is sourced from PubChem (CID 62773174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).