2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol

C12H24N2O2 — CID 111753080

IUPAC2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol
SMILESC=C(C)CN(CCO)CCN1CCOCC1
InChIInChI=1S/C12H24N2O2/c1-12(2)11-14(5-8-15)4-3-13-6-9-16-10-7-13/h15H,1,3-11H2,2H3
InChIKeyQPYMDZPHZDYIOD-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.19
Rot. Bonds7

About 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol

2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol (PubChem CID 111753080) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol
PubChem CID111753080
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol
SMILESC=C(C)CN(CCO)CCN1CCOCC1
InChIInChI=1S/C12H24N2O2/c1-12(2)11-14(5-8-15)4-3-13-6-9-16-10-7-13/h15H,1,3-11H2,2H3
InChIKeyQPYMDZPHZDYIOD-UHFFFAOYSA-N
XLogP0.19
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol?
The IUPAC name of 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol (CID 111753080) is 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol.
What is the SMILES notation for 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol?
The canonical SMILES for 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol is C=C(C)CN(CCO)CCN1CCOCC1.
What is the InChIKey of 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol?
The InChIKey is QPYMDZPHZDYIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-12(2)11-14(5-8-15)4-3-13-6-9-16-10-7-13/h15H,1,3-11H2,2H3.
What are the key properties of 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol?
2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol has a molecular weight of 228.34 g/mol, XLogP of 0.19, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methylprop-2-enyl(2-morpholin-4-ylethyl)amino]ethanol is sourced from PubChem (CID 111753080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).