2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol

C10H21NO2 — CID 104577928

IUPAC2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol
SMILESCC(C)(NCCOCCO)C1CC1
InChIInChI=1S/C10H21NO2/c1-10(2,9-3-4-9)11-5-7-13-8-6-12/h9,11-12H,3-8H2,1-2H3
InChIKeyDYKHYBCJVYRIRR-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.77
Rot. Bonds7

About 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol

2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol (PubChem CID 104577928) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol
PubChem CID104577928
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol
SMILESCC(C)(NCCOCCO)C1CC1
InChIInChI=1S/C10H21NO2/c1-10(2,9-3-4-9)11-5-7-13-8-6-12/h9,11-12H,3-8H2,1-2H3
InChIKeyDYKHYBCJVYRIRR-UHFFFAOYSA-N
XLogP0.77
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.77
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

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CID 104578024
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CID 150900173
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2-[2-[2-[2-(2-methylpentadecan-2-ylamino)ethoxy]ethoxy]ethoxy]ethanol
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3-butoxy-2-cyclopropyl-2-(ethylamino)propan-1-ol
CID 64807100
N-(2-bromoprop-2-enyl)-2-cyclopropylpropan-2-amine
CID 103950007
2-cyclopropyl-N-(3-methylsulfanylpropyl)propan-2-amine
CID 103949991
2-[2-(cyclohexylamino)ethoxy]ethanol
CID 3361598
2-[2-[4-[2-[2-(methylamino)ethoxy]ethoxy]butoxy]ethoxy]ethanol
CID 134581965
2-[2-(2-hydroxyethoxy)ethylamino]-2,4-dimethylpentanoic acid
CID 115000691
2-[2-[2-[2-[2-[2-[2-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)cyclohexyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 154735179
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)cyclohexyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 154735188

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol (CID 104577928) is 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol is CC(C)(NCCOCCO)C1CC1.
What is the InChIKey of 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol?
The InChIKey is DYKHYBCJVYRIRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-10(2,9-3-4-9)11-5-7-13-8-6-12/h9,11-12H,3-8H2,1-2H3.
What are the key properties of 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol?
2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol has a molecular weight of 187.28 g/mol, XLogP of 0.77, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol is sourced from PubChem (CID 104577928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).