2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol

C10H23NO4 — CID 87459589

IUPAC2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol
SMILESCCCCOC(N)COCCOCCO
InChIInChI=1S/C10H23NO4/c1-2-3-5-15-10(11)9-14-8-7-13-6-4-12/h10,12H,2-9,11H2,1H3
InChIKeyNVOWJLUFVHZNEE-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.11
Rot. Bonds11

About 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol

2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol (PubChem CID 87459589) has the molecular formula C10H23NO4 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol
PubChem CID87459589
Molecular FormulaC10H23NO4
Molecular Weight221.30 g/mol
Exact Mass221.16
IUPAC Name2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol
SMILESCCCCOC(N)COCCOCCO
InChIInChI=1S/C10H23NO4/c1-2-3-5-15-10(11)9-14-8-7-13-6-4-12/h10,12H,2-9,11H2,1H3
InChIKeyNVOWJLUFVHZNEE-UHFFFAOYSA-N
XLogP0.11
TPSA73.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-[2-[2-(2-amino-2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 90384666
2-(2-butoxyethoxy)ethanol;ethane-1,2-diol
CID 18459544
2-(2-butoxyethoxy)ethanol;ethane-1,2-diol;2-(2-hydroxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
CID 174801063
2-[2-(2-hydroxyethoxy)ethoxy]-1-pentadecoxyethanol
CID 158422063
1-dodecoxy-2-[2-(2-hydroxyethoxy)ethoxy]ethanol
CID 87802257
2-butoxyethanol
CID 8133
2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol;1-propoxybutane
CID 175351747
2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethanol;1-propoxybutane
CID 175100397
2-amino-3-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]propan-1-ol
CID 104567836
2-(1,2-dibutoxyethoxy)ethanol
CID 57055160
2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]butoxy]ethoxy]ethoxy]ethanol
CID 18724197
2-(2-hydroxyethoxy)ethanol;pentane
CID 157305945

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol?
The IUPAC name of 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol (CID 87459589) is 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol?
The canonical SMILES for 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol is CCCCOC(N)COCCOCCO.
What is the InChIKey of 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol?
The InChIKey is NVOWJLUFVHZNEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO4/c1-2-3-5-15-10(11)9-14-8-7-13-6-4-12/h10,12H,2-9,11H2,1H3.
What are the key properties of 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol?
2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol has a molecular weight of 221.30 g/mol, XLogP of 0.11, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-amino-2-butoxyethoxy)ethoxy]ethanol is sourced from PubChem (CID 87459589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).