6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)

C11H13N2Rb — CID 177176406

IUPAC6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)
SMILESCCc1cc2cn[c-]n2cc1CC.[Rb+]
InChIInChI=1S/C11H13N2.Rb/c1-3-9-5-11-6-12-8-13(11)7-10(9)4-2;/h5-7H,3-4H2,1-2H3;/q-1;+1
InChIKeyOIWLQCXKSGHELE-UHFFFAOYSA-N
MW258.71 g/mol
LogP-0.74
Rot. Bonds2

About 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)

6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+) (PubChem CID 177176406) has the molecular formula C11H13N2Rb and a molecular weight of 258.71 g/mol. Its IUPAC name is 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+).

Molecular Properties

Compound Name6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)
PubChem CID177176406
Molecular FormulaC11H13N2Rb
Molecular Weight258.71 g/mol
Exact Mass258.02
IUPAC Name6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)
SMILESCCc1cc2cn[c-]n2cc1CC.[Rb+]
InChIInChI=1S/C11H13N2.Rb/c1-3-9-5-11-6-12-8-13(11)7-10(9)4-2;/h5-7H,3-4H2,1-2H3;/q-1;+1
InChIKeyOIWLQCXKSGHELE-UHFFFAOYSA-N
XLogP-0.74
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.71
LogP ≤ 5-0.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

CID 59654151
CID 59654151
6,7-Dimethyl-3,8-dihydroimidazo[1,5-a]pyridine-3,8-diide;tungsten;yttrium
CID 60018607
1,4-Dimethyl-5,6-dihydrobenzimidazole
CID 144237870
(4Z,7E)-1,7-dimethyl-9-methylidene-6H-1,3-diazonine
CID 173554668
5-ethyl-7-propan-2-yl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)
CID 177176418
methane;5-methyl-7-propan-2-yl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)
CID 177176640
5,7-di(propan-2-yl)-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)
CID 177176727

Frequently Asked Questions

What is the IUPAC name of 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)?
The IUPAC name of 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+) (CID 177176406) is 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+).
What is the SMILES notation for 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)?
The canonical SMILES for 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+) is CCc1cc2cn[c-]n2cc1CC.[Rb+].
What is the InChIKey of 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)?
The InChIKey is OIWLQCXKSGHELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N2.Rb/c1-3-9-5-11-6-12-8-13(11)7-10(9)4-2;/h5-7H,3-4H2,1-2H3;/q-1;+1.
What are the key properties of 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+)?
6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+) has a molecular weight of 258.71 g/mol, XLogP of -0.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-diethyl-3H-imidazo[1,5-a]pyridin-3-ide;rubidium(1+) is sourced from PubChem (CID 177176406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).