ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol

C11H25NO2 — CID 142314187

IUPACethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol
SMILESC=C(C)CN(CCO)CCOC.CC
InChIInChI=1S/C9H19NO2.C2H6/c1-9(2)8-10(4-6-11)5-7-12-3;1-2/h11H,1,4-8H2,2-3H3;1-2H3
InChIKeyOCFHYDSAPMRRGE-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.53
Rot. Bonds7

About ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol

ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol (PubChem CID 142314187) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol.

Molecular Properties

Compound Nameethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol
PubChem CID142314187
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Nameethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol
SMILESC=C(C)CN(CCO)CCOC.CC
InChIInChI=1S/C9H19NO2.C2H6/c1-9(2)8-10(4-6-11)5-7-12-3;1-2/h11H,1,4-8H2,2-3H3;1-2H3
InChIKeyOCFHYDSAPMRRGE-UHFFFAOYSA-N
XLogP1.53
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[Methyl(3-methylbut-2-en-1-yl)amino]ethan-1-ol
CID 60683958
2-[2-Hydroxyethyl(2-methylprop-2-enyl)amino]ethanol
CID 42881
N-(2-Hydroxyethyl)-N,N,2-trimethylprop-2-en-1-aminium chloride
CID 71328243
2-[Bis(3-methylbut-2-enyl)amino]ethanol
CID 10397813
2-[2-Hydroxyethyl(3-methylbut-2-enyl)amino]ethanol
CID 18416769
N-hydroxyethyl-N,2-dimethyl-2-propene-1-amine
CID 52146248
3-[Methyl-[2-[(2-methylpropan-2-yl)oxy]ethyl]amino]prop-1-en-2-ol
CID 58018178
2-[Ethyl(2-methylprop-2-enyl)amino]ethanol
CID 60685613
2-[Butyl(2-methylprop-2-enyl)amino]ethanol
CID 60689114
2-[Butyl(2-methylidenebutyl)amino]ethanol
CID 66038306
2-[2-Hydroxyethyl-[2-(2-methylprop-2-enoxy)ethyl]amino]ethanol
CID 87217565
N-(2-methoxyethyl)-N,2-dimethylprop-2-en-1-amine
CID 102253983

Frequently Asked Questions

What is the IUPAC name of ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol?
The IUPAC name of ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol (CID 142314187) is ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol.
What is the SMILES notation for ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol?
The canonical SMILES for ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol is C=C(C)CN(CCO)CCOC.CC.
What is the InChIKey of ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol?
The InChIKey is OCFHYDSAPMRRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2.C2H6/c1-9(2)8-10(4-6-11)5-7-12-3;1-2/h11H,1,4-8H2,2-3H3;1-2H3.
What are the key properties of ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol?
ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol has a molecular weight of 203.33 g/mol, XLogP of 1.53, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-[2-methoxyethyl(2-methylprop-2-enyl)amino]ethanol is sourced from PubChem (CID 142314187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).