2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol

C8H17NO2 — CID 114467469

IUPAC2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol
SMILESC=C(C)COCCNCCO
InChIInChI=1S/C8H17NO2/c1-8(2)7-11-6-4-9-3-5-10/h9-10H,1,3-7H2,2H3
InChIKeyZBAZHMDXLLRMRU-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.16
Rot. Bonds7

About 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol

2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol (PubChem CID 114467469) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol.

Molecular Properties

Compound Name2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol
PubChem CID114467469
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol
SMILESC=C(C)COCCNCCO
InChIInChI=1S/C8H17NO2/c1-8(2)7-11-6-4-9-3-5-10/h9-10H,1,3-7H2,2H3
InChIKeyZBAZHMDXLLRMRU-UHFFFAOYSA-N
XLogP0.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-fluoroethyl)-2-(2-methylprop-2-enoxy)ethanamine
CID 114467132
3-fluoro-N-[2-(2-methylprop-2-enoxy)ethyl]propan-1-amine
CID 114467702
1,1,1-Trifluoro-3-[2-(2-methylprop-2-enoxy)ethylamino]propan-2-ol
CID 114467711
2-(2-methylprop-2-enoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine
CID 114467715
2-(2-methylprop-2-enoxy)-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine
CID 114467774
N-methyl-2-(2-methylprop-2-enoxy)ethanamine
CID 22947404
N-ethyl-2-(2-methylprop-2-enoxy)ethanamine
CID 62336670
2-(2-Prop-2-enoxyethylamino)ethanol
CID 87166658
2-[2-Hydroxyethyl-[2-(2-methylprop-2-enoxy)ethyl]amino]ethanol
CID 87217565
2-methyl-N-[2-(2-methylprop-2-enoxy)ethyl]propan-2-amine
CID 87899351
N-methyl-2-[2-(2-methylprop-2-enoxy)ethoxy]ethanamine
CID 88262803
2-[[(E)-3-methoxy-2-methylprop-1-enyl]amino]ethanol
CID 89259857

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol?
The IUPAC name of 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol (CID 114467469) is 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol.
What is the SMILES notation for 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol?
The canonical SMILES for 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol is C=C(C)COCCNCCO.
What is the InChIKey of 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol?
The InChIKey is ZBAZHMDXLLRMRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-8(2)7-11-6-4-9-3-5-10/h9-10H,1,3-7H2,2H3.
What are the key properties of 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol?
2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol has a molecular weight of 159.23 g/mol, XLogP of 0.16, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methylprop-2-enoxy)ethylamino]ethanol is sourced from PubChem (CID 114467469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).