2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol

C8H14N2O2 — CID 61075883

IUPAC2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol
SMILESCc1nccn1CCOCCO
InChIInChI=1S/C8H14N2O2/c1-8-9-2-3-10(8)4-6-12-7-5-11/h2-3,11H,4-7H2,1H3
InChIKeyMMDRTZNVORXYRQ-UHFFFAOYSA-N
MW170.21 g/mol
LogP0.20
Rot. Bonds5

About 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol

2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol (PubChem CID 61075883) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol
PubChem CID61075883
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol
SMILESCc1nccn1CCOCCO
InChIInChI=1S/C8H14N2O2/c1-8-9-2-3-10(8)4-6-12-7-5-11/h2-3,11H,4-7H2,1H3
InChIKeyMMDRTZNVORXYRQ-UHFFFAOYSA-N
XLogP0.20
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 50.20
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

1-(2-butoxyethyl)-2-methylimidazole
CID 63810504
2-[2-[2-(ethylaminomethyl)imidazol-1-yl]ethoxy]ethanol
CID 62221793
2-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazole
CID 112687525
[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol
CID 62223688
1-[2-(4-methoxyphenoxy)ethyl]-2-methylimidazole
CID 887351
tris(2-methyl-1-propylimidazole);trihydroiodide
CID 173173325
2-[2-[2-(2-methylimidazol-1-yl)ethoxy]ethyl]piperidine
CID 62342019
2-[2-(1-methylimidazol-2-yl)ethoxy]ethanol
CID 90045312
[3-bromo-4-[2-(2-methylimidazol-1-yl)ethoxy]phenyl]methanol
CID 63051116
4-(2-methylimidazol-1-yl)butan-2-one
CID 43121484
5-[2-(2-methylimidazol-1-yl)ethylamino]pentan-1-ol
CID 107317411
[3,5-dichloro-2-[2-(2-methylimidazol-1-yl)ethoxy]phenyl]methanol
CID 61493875

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol?
The IUPAC name of 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol (CID 61075883) is 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol?
The canonical SMILES for 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol is Cc1nccn1CCOCCO.
What is the InChIKey of 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol?
The InChIKey is MMDRTZNVORXYRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-8-9-2-3-10(8)4-6-12-7-5-11/h2-3,11H,4-7H2,1H3.
What are the key properties of 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol?
2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol has a molecular weight of 170.21 g/mol, XLogP of 0.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methylimidazol-1-yl)ethoxy]ethanol is sourced from PubChem (CID 61075883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).