1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine

C11H19N3O2 — CID 106577277

IUPAC1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine
SMILESCOCCn1cc(C)nc1NC1CCOC1
InChIInChI=1S/C11H19N3O2/c1-9-7-14(4-6-15-2)11(12-9)13-10-3-5-16-8-10/h7,10H,3-6,8H2,1-2H3,(H,12,13)
InChIKeyLUEXDDFIXIHXBZ-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.04
Rot. Bonds5

About 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine

1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine (PubChem CID 106577277) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine
PubChem CID106577277
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine
SMILESCOCCn1cc(C)nc1NC1CCOC1
InChIInChI=1S/C11H19N3O2/c1-9-7-14(4-6-15-2)11(12-9)13-10-3-5-16-8-10/h7,10H,3-6,8H2,1-2H3,(H,12,13)
InChIKeyLUEXDDFIXIHXBZ-UHFFFAOYSA-N
XLogP1.04
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine?
The IUPAC name of 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine (CID 106577277) is 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine?
The canonical SMILES for 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine is COCCn1cc(C)nc1NC1CCOC1.
What is the InChIKey of 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine?
The InChIKey is LUEXDDFIXIHXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-9-7-14(4-6-15-2)11(12-9)13-10-3-5-16-8-10/h7,10H,3-6,8H2,1-2H3,(H,12,13).
What are the key properties of 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine?
1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine has a molecular weight of 225.29 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine is sourced from PubChem (CID 106577277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).