(9-propylpurin-2-yl)azanide;rubidium(1+)

C8H10N5Rb — CID 145214378

IUPAC(9-propylpurin-2-yl)azanide;rubidium(1+)
SMILESCCCn1cnc2cnc([NH-])nc21.[Rb+]
InChIInChI=1S/C8H10N5.Rb/c1-2-3-13-5-11-6-4-10-8(9)12-7(6)13;/h4-5H,2-3H2,1H3,(H-,9,10,12);/q-1;+1
InChIKeyDGXVKWJXQQHMPL-UHFFFAOYSA-N
MW261.67 g/mol
LogP-1.08
Rot. Bonds2

About (9-propylpurin-2-yl)azanide;rubidium(1+)

(9-propylpurin-2-yl)azanide;rubidium(1+) (PubChem CID 145214378) has the molecular formula C8H10N5Rb and a molecular weight of 261.67 g/mol. Its IUPAC name is (9-propylpurin-2-yl)azanide;rubidium(1+).

Molecular Properties

Compound Name(9-propylpurin-2-yl)azanide;rubidium(1+)
PubChem CID145214378
Molecular FormulaC8H10N5Rb
Molecular Weight261.67 g/mol
Exact Mass261.01
IUPAC Name(9-propylpurin-2-yl)azanide;rubidium(1+)
SMILESCCCn1cnc2cnc([NH-])nc21.[Rb+]
InChIInChI=1S/C8H10N5.Rb/c1-2-3-13-5-11-6-4-10-8(9)12-7(6)13;/h4-5H,2-3H2,1H3,(H-,9,10,12);/q-1;+1
InChIKeyDGXVKWJXQQHMPL-UHFFFAOYSA-N
XLogP-1.08
TPSA67.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.67
LogP ≤ 5-1.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (9-propylpurin-2-yl)azanide;rubidium(1+)?
The IUPAC name of (9-propylpurin-2-yl)azanide;rubidium(1+) (CID 145214378) is (9-propylpurin-2-yl)azanide;rubidium(1+).
What is the SMILES notation for (9-propylpurin-2-yl)azanide;rubidium(1+)?
The canonical SMILES for (9-propylpurin-2-yl)azanide;rubidium(1+) is CCCn1cnc2cnc([NH-])nc21.[Rb+].
What is the InChIKey of (9-propylpurin-2-yl)azanide;rubidium(1+)?
The InChIKey is DGXVKWJXQQHMPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N5.Rb/c1-2-3-13-5-11-6-4-10-8(9)12-7(6)13;/h4-5H,2-3H2,1H3,(H-,9,10,12);/q-1;+1.
What are the key properties of (9-propylpurin-2-yl)azanide;rubidium(1+)?
(9-propylpurin-2-yl)azanide;rubidium(1+) has a molecular weight of 261.67 g/mol, XLogP of -1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (9-propylpurin-2-yl)azanide;rubidium(1+) is sourced from PubChem (CID 145214378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).