1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole

C10H18N2O2 — CID 90402630

IUPAC1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole
SMILESCOCCOCn1ccnc1C(C)C
InChIInChI=1S/C10H18N2O2/c1-9(2)10-11-4-5-12(10)8-14-7-6-13-3/h4-5,9H,6-8H2,1-3H3
InChIKeyJRFASZJJXBOIPS-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.63
Rot. Bonds6

About 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole

1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole (PubChem CID 90402630) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole.

Molecular Properties

Compound Name1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole
PubChem CID90402630
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole
SMILESCOCCOCn1ccnc1C(C)C
InChIInChI=1S/C10H18N2O2/c1-9(2)10-11-4-5-12(10)8-14-7-6-13-3/h4-5,9H,6-8H2,1-3H3
InChIKeyJRFASZJJXBOIPS-UHFFFAOYSA-N
XLogP1.63
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.63
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-(3-ethoxypropyl)-2-propan-2-ylimidazole
CID 65177942
2-[2-(2-propan-2-ylimidazol-1-yl)ethoxy]ethanamine
CID 103482299
(2-propan-2-ylimidazol-1-yl)methyl 2-methylprop-2-enoate
CID 139855142
N-ethyl-1-methoxy-3-(2-propan-2-ylimidazol-1-yl)propan-2-amine
CID 107506086
methyl 2-methyl-3-(2-propan-2-ylimidazol-1-yl)propanoate
CID 43538211
N-ethyl-1-(1-ethylimidazol-2-yl)-2-(2-methoxyethoxy)ethanamine
CID 114032819
3-(2-methoxyethoxy)-1-(1-propylimidazol-2-yl)propan-1-amine
CID 102927817
[1-(1-ethylimidazol-2-yl)-3-(2-methoxyethoxy)propyl]hydrazine
CID 102929970
3-(2-methoxyethoxy)-1-(1-propylimidazol-2-yl)propan-1-ol
CID 102927681
(2S)-1-(2-propan-2-ylimidazol-1-yl)propan-2-amine
CID 28794327
1-(2-fluoroethyl)-2-propan-2-ylimidazole
CID 80694983
1-(5-chloropentyl)-2-propan-2-ylimidazole
CID 43168520

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole?
The IUPAC name of 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole (CID 90402630) is 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole.
What is the SMILES notation for 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole?
The canonical SMILES for 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole is COCCOCn1ccnc1C(C)C.
What is the InChIKey of 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole?
The InChIKey is JRFASZJJXBOIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-9(2)10-11-4-5-12(10)8-14-7-6-13-3/h4-5,9H,6-8H2,1-3H3.
What are the key properties of 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole?
1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole has a molecular weight of 198.27 g/mol, XLogP of 1.63, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole is sourced from PubChem (CID 90402630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).