azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)

C80H121N23O4RbS5- — CID 159487526

IUPACazane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)
SMILESCC1=CC(C)=NC1.CC1=CC=C(C)C1.CC1=CN=C(C)C1.CC1=NC(C)=NC1.CC1=NN=C(C)C1.Cc1cc(C)on1.Cc1cc(C)sn1.Cc1ccc(C)s1.Cc1cn(C)nn1.Cc1cnc(C)o1.Cc1cnc(C)s1.Cc1nnc(C)o1.Cc1nnc(C)s1.Cc1noc(C)n1.Cc1nsc(C)n1.N.[H]/[C-]=C(C)/N=[C-]/C.[Rb+]
InChIInChI=1S/C7H10.2C6H9N.C6H8S.2C5H8N2.2C5H7NO.2C5H7NS.C5H7N.C4H7N3.2C4H6N2O.2C4H6N2S.H3N.Rb/c1-6-3-4-7(2)5-6;2*1-5-3-6(2)7-4-5;1-5-3-4-6(2)7-5;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-6-5(2)3;1-4-3-7(2)6-5-4;1-3-5-6-4(2)7-3;1-3-5-4(2)7-6-3;1-3-5-6-4(2)7-3;1-3-5-4(2)7-6-3;;/h3-4H,5H2,1-2H3;4H,3H2,1-2H3;3H,4H2,1-2H3;3-4H,1-2H3;2*3H2,1-2H3;4*3H,1-2H3;2H,1,3H3;3H,1-2H3;4*1-2H3;1H3;/q;;;;;;;;;;-2;;;;;;;+1
InChIKeyFQJRARLFSDATDB-UHFFFAOYSA-N
MW1714.81 g/mol
LogP18.28
Rot. Bonds1

About azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)

azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+) (PubChem CID 159487526) has the molecular formula C80H121N23O4RbS5- and a molecular weight of 1714.81 g/mol. Its IUPAC name is azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+).

Molecular Properties

Compound Nameazane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)
PubChem CID159487526
Molecular FormulaC80H121N23O4RbS5-
Molecular Weight1714.81 g/mol
Exact Mass1712.77
IUPAC Nameazane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)
SMILESCC1=CC(C)=NC1.CC1=CC=C(C)C1.CC1=CN=C(C)C1.CC1=NC(C)=NC1.CC1=NN=C(C)C1.Cc1cc(C)on1.Cc1cc(C)sn1.Cc1ccc(C)s1.Cc1cn(C)nn1.Cc1cnc(C)o1.Cc1cnc(C)s1.Cc1nnc(C)o1.Cc1nnc(C)s1.Cc1noc(C)n1.Cc1nsc(C)n1.N.[H]/[C-]=C(C)/N=[C-]/C.[Rb+]
InChIInChI=1S/C7H10.2C6H9N.C6H8S.2C5H8N2.2C5H7NO.2C5H7NS.C5H7N.C4H7N3.2C4H6N2O.2C4H6N2S.H3N.Rb/c1-6-3-4-7(2)5-6;2*1-5-3-6(2)7-4-5;1-5-3-4-6(2)7-5;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-6-5(2)3;1-4-3-7(2)6-5-4;1-3-5-6-4(2)7-3;1-3-5-4(2)7-6-3;1-3-5-6-4(2)7-3;1-3-5-4(2)7-6-3;;/h3-4H,5H2,1-2H3;4H,3H2,1-2H3;3H,4H2,1-2H3;3-4H,1-2H3;2*3H2,1-2H3;4*3H,1-2H3;2H,1,3H3;3H,1-2H3;4*1-2H3;1H3;/q;;;;;;;;;;-2;;;;;;;+1
InChIKeyFQJRARLFSDATDB-UHFFFAOYSA-N
XLogP18.28
TPSA359.47 Ų
H-Bond Donors1
H-Bond Acceptors32
Rotatable Bonds1
Heavy Atoms113
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001714.81
LogP ≤ 518.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)?
The IUPAC name of azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+) (CID 159487526) is azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+).
What is the SMILES notation for azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)?
The canonical SMILES for azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+) is CC1=CC(C)=NC1.CC1=CC=C(C)C1.CC1=CN=C(C)C1.CC1=NC(C)=NC1.CC1=NN=C(C)C1.Cc1cc(C)on1.Cc1cc(C)sn1.Cc1ccc(C)s1.Cc1cn(C)nn1.Cc1cnc(C)o1.Cc1cnc(C)s1.Cc1nnc(C)o1.Cc1nnc(C)s1.Cc1noc(C)n1.Cc1nsc(C)n1.N.[H]/[C-]=C(C)/N=[C-]/C.[Rb+].
What is the InChIKey of azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)?
The InChIKey is FQJRARLFSDATDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10.2C6H9N.C6H8S.2C5H8N2.2C5H7NO.2C5H7NS.C5H7N.C4H7N3.2C4H6N2O.2C4H6N2S.H3N.Rb/c1-6-3-4-7(2)5-6;2*1-5-3-6(2)7-4-5;1-5-3-4-6(2)7-5;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-6-5(2)3;1-4-3-7(2)6-5-4;1-3-5-6-4(2)7-3;1-3-5-4(2)7-6-3;1-3-5-6-4(2)7-3;1-3-5-4(2)7-6-3;;/h3-4H,5H2,1-2H3;4H,3H2,1-2H3;3H,4H2,1-2H3;3-4H,1-2H3;2*3H2,1-2H3;4*3H,1-2H3;2H,1,3H3;3H,1-2H3;4*1-2H3;1H3;/q;;;;;;;;;;-2;;;;;;;+1.
What are the key properties of azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+)?
azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+) has a molecular weight of 1714.81 g/mol, XLogP of 18.28, 1 rotatable bonds, 1 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1,4-dimethylcyclopenta-1,3-diene;2,5-dimethyl-4H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4H-pyrazole;2,4-dimethyl-3H-pyrrole;3,5-dimethyl-2H-pyrrole;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;2,5-dimethyl-1,3-thiazole;3,5-dimethyl-1,2-thiazole;2,5-dimethylthiophene;1,4-dimethyltriazole;N-prop-1-en-2-ylethanimine;rubidium(1+) is sourced from PubChem (CID 159487526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).