1-[2-(2-propoxyethoxy)ethyl]imidazole

C10H18N2O2 — CID 54030122

IUPAC1-[2-(2-propoxyethoxy)ethyl]imidazole
SMILESCCCOCCOCCn1ccnc1
InChIInChI=1S/C10H18N2O2/c1-2-6-13-8-9-14-7-5-12-4-3-11-10-12/h3-4,10H,2,5-9H2,1H3
InChIKeyYNMIKDIHEXOUAS-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.33
Rot. Bonds8

About 1-[2-(2-propoxyethoxy)ethyl]imidazole

1-[2-(2-propoxyethoxy)ethyl]imidazole (PubChem CID 54030122) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 1-[2-(2-propoxyethoxy)ethyl]imidazole.

Molecular Properties

Compound Name1-[2-(2-propoxyethoxy)ethyl]imidazole
PubChem CID54030122
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name1-[2-(2-propoxyethoxy)ethyl]imidazole
SMILESCCCOCCOCCn1ccnc1
InChIInChI=1S/C10H18N2O2/c1-2-6-13-8-9-14-7-5-12-4-3-11-10-12/h3-4,10H,2,5-9H2,1H3
InChIKeyYNMIKDIHEXOUAS-UHFFFAOYSA-N
XLogP1.33
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.33
H-Bond Donors ≤ 50
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-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]imidazole
CID 66705550
1-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethyl]imidazole
CID 176721409
2-(2-imidazol-1-ylethoxy)-N-methylethanamine
CID 106937829
1-methylimidazole;1-propoxypropane
CID 158766407
3-(2-imidazol-1-ylethoxy)propan-1-amine
CID 106938071
1-(2-methoxyethyl)imidazole
CID 14366840
1-(2-prop-2-enoxyethyl)imidazole
CID 141049243
1-(13-ethoxytridecyl)imidazole
CID 145255635
1-[2-[2-[2-[(2R)-butan-2-yl]phenoxy]ethoxy]ethyl]imidazole
CID 40609983
sodium;1-butylimidazole;bromide
CID 175480877
1-[3-(2,2-dimethylpropoxy)propyl]imidazole
CID 166921523
bis(1-butylimidazole);heptane;dihydrobromide
CID 175107148

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-propoxyethoxy)ethyl]imidazole?
The IUPAC name of 1-[2-(2-propoxyethoxy)ethyl]imidazole (CID 54030122) is 1-[2-(2-propoxyethoxy)ethyl]imidazole.
What is the SMILES notation for 1-[2-(2-propoxyethoxy)ethyl]imidazole?
The canonical SMILES for 1-[2-(2-propoxyethoxy)ethyl]imidazole is CCCOCCOCCn1ccnc1.
What is the InChIKey of 1-[2-(2-propoxyethoxy)ethyl]imidazole?
The InChIKey is YNMIKDIHEXOUAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-2-6-13-8-9-14-7-5-12-4-3-11-10-12/h3-4,10H,2,5-9H2,1H3.
What are the key properties of 1-[2-(2-propoxyethoxy)ethyl]imidazole?
1-[2-(2-propoxyethoxy)ethyl]imidazole has a molecular weight of 198.27 g/mol, XLogP of 1.33, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-propoxyethoxy)ethyl]imidazole is sourced from PubChem (CID 54030122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).