2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)

C12H15N2Rb — CID 163219067

IUPAC2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)
SMILESC[C-]1C=CN2C=C(C(C)C)C=CC2=N1.[Rb+]
InChIInChI=1S/C12H15N2.Rb/c1-9(2)11-4-5-12-13-10(3)6-7-14(12)8-11;/h4-9H,1-3H3;/q-1;+1
InChIKeyYNJNBMITYLKTIE-UHFFFAOYSA-N
MW272.73 g/mol
LogP-0.12
Rot. Bonds1

About 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)

2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+) (PubChem CID 163219067) has the molecular formula C12H15N2Rb and a molecular weight of 272.73 g/mol. Its IUPAC name is 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+).

Molecular Properties

Compound Name2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)
PubChem CID163219067
Molecular FormulaC12H15N2Rb
Molecular Weight272.73 g/mol
Exact Mass272.04
IUPAC Name2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)
SMILESC[C-]1C=CN2C=C(C(C)C)C=CC2=N1.[Rb+]
InChIInChI=1S/C12H15N2.Rb/c1-9(2)11-4-5-12-13-10(3)6-7-14(12)8-11;/h4-9H,1-3H3;/q-1;+1
InChIKeyYNJNBMITYLKTIE-UHFFFAOYSA-N
XLogP-0.12
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.73
LogP ≤ 5-0.12
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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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)?
The IUPAC name of 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+) (CID 163219067) is 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+).
What is the SMILES notation for 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)?
The canonical SMILES for 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+) is C[C-]1C=CN2C=C(C(C)C)C=CC2=N1.[Rb+].
What is the InChIKey of 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)?
The InChIKey is YNJNBMITYLKTIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N2.Rb/c1-9(2)11-4-5-12-13-10(3)6-7-14(12)8-11;/h4-9H,1-3H3;/q-1;+1.
What are the key properties of 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+)?
2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+) has a molecular weight of 272.73 g/mol, XLogP of -0.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-propan-2-ylpyrido[1,2-a]pyrimidin-2-ide;rubidium(1+) is sourced from PubChem (CID 163219067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).