2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol

C11H25NO3 — CID 103182683

IUPAC2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol
SMILESCOCCCOCCN(CCO)C(C)C
InChIInChI=1S/C11H25NO3/c1-11(2)12(5-7-13)6-10-15-9-4-8-14-3/h11,13H,4-10H2,1-3H3
InChIKeyWJGCHTZNNLDPHG-UHFFFAOYSA-N
MW219.32 g/mol
LogP0.74
Rot. Bonds10

About 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol

2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol (PubChem CID 103182683) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol.

Molecular Properties

Compound Name2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol
PubChem CID103182683
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC Name2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol
SMILESCOCCCOCCN(CCO)C(C)C
InChIInChI=1S/C11H25NO3/c1-11(2)12(5-7-13)6-10-15-9-4-8-14-3/h11,13H,4-10H2,1-3H3
InChIKeyWJGCHTZNNLDPHG-UHFFFAOYSA-N
XLogP0.74
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.32
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[4-methoxybutyl(propan-2-yl)amino]ethanol
CID 115685977
3-methoxy-N-(2-methoxyethyl)-N-propan-2-ylpropan-1-amine
CID 177187385
3-[2-(3-methylbutoxy)ethyl-propan-2-ylamino]propan-1-ol
CID 62015016
3-[propan-2-yl-[2-(2,2,2-trifluoroethoxy)ethyl]amino]propan-1-ol
CID 62015613
1-methoxy-3-[3-(3-methoxypropoxy)propoxy]propane
CID 6432627
N'-[3-(2-methoxyethoxy)propyl]-N'-propan-2-ylpropane-1,3-diamine
CID 103409174
N-(2-chloroethyl)-3-(2-methoxyethoxy)-N-propan-2-ylpropan-1-amine
CID 103413010
3-chloro-N-(2-methoxyethyl)-N-propan-2-ylpropan-1-amine
CID 63389217
4-[2-methoxyethyl(propan-2-yl)amino]butan-2-ol
CID 82961213
N'-(2-methoxyethyl)-N'-propan-2-ylpropane-1,3-diamine
CID 43137377
2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol
CID 130537128
2-[3-methoxypropyl(pentan-3-yl)amino]ethanol
CID 62015077

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol?
The IUPAC name of 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol (CID 103182683) is 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol.
What is the SMILES notation for 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol?
The canonical SMILES for 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol is COCCCOCCN(CCO)C(C)C.
What is the InChIKey of 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol?
The InChIKey is WJGCHTZNNLDPHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-11(2)12(5-7-13)6-10-15-9-4-8-14-3/h11,13H,4-10H2,1-3H3.
What are the key properties of 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol?
2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol has a molecular weight of 219.32 g/mol, XLogP of 0.74, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol is sourced from PubChem (CID 103182683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).