1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide

C6H14BrN3O — CID 69026589

IUPAC1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide
SMILESBr.COCCN1CCN=C1N
InChIInChI=1S/C6H13N3O.BrH/c1-10-5-4-9-3-2-8-6(9)7;/h2-5H2,1H3,(H2,7,8);1H
InChIKeyKOXJIEFQJSWJNC-UHFFFAOYSA-N
MW224.10 g/mol
LogP-0.16
Rot. Bonds3

About 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide

1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide (PubChem CID 69026589) has the molecular formula C6H14BrN3O and a molecular weight of 224.10 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide
PubChem CID69026589
Molecular FormulaC6H14BrN3O
Molecular Weight224.10 g/mol
Exact Mass223.03
IUPAC Name1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide
SMILESBr.COCCN1CCN=C1N
InChIInChI=1S/C6H13N3O.BrH/c1-10-5-4-9-3-2-8-6(9)7;/h2-5H2,1H3,(H2,7,8);1H
InChIKeyKOXJIEFQJSWJNC-UHFFFAOYSA-N
XLogP-0.16
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.10
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide?
The IUPAC name of 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide (CID 69026589) is 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide.
What is the SMILES notation for 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide?
The canonical SMILES for 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide is Br.COCCN1CCN=C1N.
What is the InChIKey of 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide?
The InChIKey is KOXJIEFQJSWJNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O.BrH/c1-10-5-4-9-3-2-8-6(9)7;/h2-5H2,1H3,(H2,7,8);1H.
What are the key properties of 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide?
1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide has a molecular weight of 224.10 g/mol, XLogP of -0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine;hydrobromide is sourced from PubChem (CID 69026589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).