2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)

C7H11N2ORb — CID 59168923

IUPAC2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)
SMILESCCC(C)(O)c1c[n-]cn1.[Rb+]
InChIInChI=1S/C7H11N2O.Rb/c1-3-7(2,10)6-4-8-5-9-6;/h4-5,10H,3H2,1-2H3;/q-1;+1
InChIKeyMWYUWHVTRJXRGK-UHFFFAOYSA-N
MW224.65 g/mol
LogP-2.34
Rot. Bonds2

About 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)

2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+) (PubChem CID 59168923) has the molecular formula C7H11N2ORb and a molecular weight of 224.65 g/mol. Its IUPAC name is 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+).

Molecular Properties

Compound Name2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)
PubChem CID59168923
Molecular FormulaC7H11N2ORb
Molecular Weight224.65 g/mol
Exact Mass224.00
IUPAC Name2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)
SMILESCCC(C)(O)c1c[n-]cn1.[Rb+]
InChIInChI=1S/C7H11N2O.Rb/c1-3-7(2,10)6-4-8-5-9-6;/h4-5,10H,3H2,1-2H3;/q-1;+1
InChIKeyMWYUWHVTRJXRGK-UHFFFAOYSA-N
XLogP-2.34
TPSA47.22 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.65
LogP ≤ 5-2.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)?
The IUPAC name of 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+) (CID 59168923) is 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+).
What is the SMILES notation for 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)?
The canonical SMILES for 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+) is CCC(C)(O)c1c[n-]cn1.[Rb+].
What is the InChIKey of 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)?
The InChIKey is MWYUWHVTRJXRGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N2O.Rb/c1-3-7(2,10)6-4-8-5-9-6;/h4-5,10H,3H2,1-2H3;/q-1;+1.
What are the key properties of 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)?
2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+) has a molecular weight of 224.65 g/mol, XLogP of -2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+) is sourced from PubChem (CID 59168923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).