1,3-bis(2-methoxyethyl)-2H-imidazole

C9H18N2O2 — CID 69236026

IUPAC1,3-bis(2-methoxyethyl)-2H-imidazole
SMILESCOCCN1C=CN(CCOC)C1
InChIInChI=1S/C9H18N2O2/c1-12-7-5-10-3-4-11(9-10)6-8-13-2/h3-4H,5-9H2,1-2H3
InChIKeyVXVBIEQYKGVCKF-UHFFFAOYSA-N
MW186.25 g/mol
LogP0.33
Rot. Bonds6

About 1,3-bis(2-methoxyethyl)-2H-imidazole

1,3-bis(2-methoxyethyl)-2H-imidazole (PubChem CID 69236026) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 1,3-bis(2-methoxyethyl)-2H-imidazole.

Molecular Properties

Compound Name1,3-bis(2-methoxyethyl)-2H-imidazole
PubChem CID69236026
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name1,3-bis(2-methoxyethyl)-2H-imidazole
SMILESCOCCN1C=CN(CCOC)C1
InChIInChI=1S/C9H18N2O2/c1-12-7-5-10-3-4-11(9-10)6-8-13-2/h3-4H,5-9H2,1-2H3
InChIKeyVXVBIEQYKGVCKF-UHFFFAOYSA-N
XLogP0.33
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(2-methoxyethyl)-2H-imidazole?
The IUPAC name of 1,3-bis(2-methoxyethyl)-2H-imidazole (CID 69236026) is 1,3-bis(2-methoxyethyl)-2H-imidazole.
What is the SMILES notation for 1,3-bis(2-methoxyethyl)-2H-imidazole?
The canonical SMILES for 1,3-bis(2-methoxyethyl)-2H-imidazole is COCCN1C=CN(CCOC)C1.
What is the InChIKey of 1,3-bis(2-methoxyethyl)-2H-imidazole?
The InChIKey is VXVBIEQYKGVCKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-12-7-5-10-3-4-11(9-10)6-8-13-2/h3-4H,5-9H2,1-2H3.
What are the key properties of 1,3-bis(2-methoxyethyl)-2H-imidazole?
1,3-bis(2-methoxyethyl)-2H-imidazole has a molecular weight of 186.25 g/mol, XLogP of 0.33, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(2-methoxyethyl)-2H-imidazole is sourced from PubChem (CID 69236026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).