2-[2-(prop-1-enylamino)ethoxy]ethanol

C7H15NO2 — CID 154242626

IUPAC2-[2-(prop-1-enylamino)ethoxy]ethanol
SMILESCC=CNCCOCCO
InChIInChI=1S/C7H15NO2/c1-2-3-8-4-6-10-7-5-9/h2-3,8-9H,4-7H2,1H3
InChIKeySAHRAQMGAAOQBT-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.12
Rot. Bonds6

About 2-[2-(prop-1-enylamino)ethoxy]ethanol

2-[2-(prop-1-enylamino)ethoxy]ethanol (PubChem CID 154242626) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 2-[2-(prop-1-enylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(prop-1-enylamino)ethoxy]ethanol
PubChem CID154242626
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name2-[2-(prop-1-enylamino)ethoxy]ethanol
SMILESCC=CNCCOCCO
InChIInChI=1S/C7H15NO2/c1-2-3-8-4-6-10-7-5-9/h2-3,8-9H,4-7H2,1H3
InChIKeySAHRAQMGAAOQBT-UHFFFAOYSA-N
XLogP0.12
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139594890
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139594464
2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethanol
CID 123132110
2-[2-(2-methylhydrazinyl)ethoxy]ethanol
CID 163916077
2-[2-(2-methylpropoxyamino)ethoxy]ethanol
CID 82715522
ethane;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol
CID 159638520
(E)-3-[3-(2-hydroxyethoxy)propylamino]prop-2-enoic acid
CID 106305455
2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 17472
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619695
CID 159345993
CID 159345993
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619703
2-(2-hydroxyethoxy)ethanol;dihydrate
CID 22572092

Frequently Asked Questions

What is the IUPAC name of 2-[2-(prop-1-enylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(prop-1-enylamino)ethoxy]ethanol (CID 154242626) is 2-[2-(prop-1-enylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(prop-1-enylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(prop-1-enylamino)ethoxy]ethanol is CC=CNCCOCCO.
What is the InChIKey of 2-[2-(prop-1-enylamino)ethoxy]ethanol?
The InChIKey is SAHRAQMGAAOQBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-2-3-8-4-6-10-7-5-9/h2-3,8-9H,4-7H2,1H3.
What are the key properties of 2-[2-(prop-1-enylamino)ethoxy]ethanol?
2-[2-(prop-1-enylamino)ethoxy]ethanol has a molecular weight of 145.20 g/mol, XLogP of 0.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(prop-1-enylamino)ethoxy]ethanol is sourced from PubChem (CID 154242626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).