1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole

C11H19N3O — CID 86820584

IUPAC1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole
SMILESCOCCn1c(C)cnc1C1CCNC1
InChIInChI=1S/C11H19N3O/c1-9-7-13-11(10-3-4-12-8-10)14(9)5-6-15-2/h7,10,12H,3-6,8H2,1-2H3
InChIKeyYZUZXIBOQHMXHJ-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.91
Rot. Bonds4

About 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole

1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole (PubChem CID 86820584) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole.

Molecular Properties

Compound Name1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole
PubChem CID86820584
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole
SMILESCOCCn1c(C)cnc1C1CCNC1
InChIInChI=1S/C11H19N3O/c1-9-7-13-11(10-3-4-12-8-10)14(9)5-6-15-2/h7,10,12H,3-6,8H2,1-2H3
InChIKeyYZUZXIBOQHMXHJ-UHFFFAOYSA-N
XLogP0.91
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole?
The IUPAC name of 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole (CID 86820584) is 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole.
What is the SMILES notation for 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole?
The canonical SMILES for 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole is COCCn1c(C)cnc1C1CCNC1.
What is the InChIKey of 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole?
The InChIKey is YZUZXIBOQHMXHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9-7-13-11(10-3-4-12-8-10)14(9)5-6-15-2/h7,10,12H,3-6,8H2,1-2H3.
What are the key properties of 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole?
1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole has a molecular weight of 209.29 g/mol, XLogP of 0.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole is sourced from PubChem (CID 86820584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).