5-methylindazol-2-ide;propane;rhenium

C11H15N2Re- — CID 155590157

IUPAC5-methylindazol-2-ide;propane;rhenium
SMILESCCC.Cc1ccc2n[n-]cc2c1.[Re]
InChIInChI=1S/C8H7N2.C3H8.Re/c1-6-2-3-8-7(4-6)5-9-10-8;1-3-2;/h2-5H,1H3;3H2,1-2H3;/q-1;;
InChIKeyUNLXLSUBAYNKTI-UHFFFAOYSA-N
MW361.46 g/mol
LogP2.91
Rot. Bonds

About 5-methylindazol-2-ide;propane;rhenium

5-methylindazol-2-ide;propane;rhenium (PubChem CID 155590157) has the molecular formula C11H15N2Re- and a molecular weight of 361.46 g/mol. Its IUPAC name is 5-methylindazol-2-ide;propane;rhenium.

Molecular Properties

Compound Name5-methylindazol-2-ide;propane;rhenium
PubChem CID155590157
Molecular FormulaC11H15N2Re-
Molecular Weight361.46 g/mol
Exact Mass362.08
IUPAC Name5-methylindazol-2-ide;propane;rhenium
SMILESCCC.Cc1ccc2n[n-]cc2c1.[Re]
InChIInChI=1S/C8H7N2.C3H8.Re/c1-6-2-3-8-7(4-6)5-9-10-8;1-3-2;/h2-5H,1H3;3H2,1-2H3;/q-1;;
InChIKeyUNLXLSUBAYNKTI-UHFFFAOYSA-N
XLogP2.91
TPSA26.99 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.46
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methylindazol-2-ide;propane;rhenium?
The IUPAC name of 5-methylindazol-2-ide;propane;rhenium (CID 155590157) is 5-methylindazol-2-ide;propane;rhenium.
What is the SMILES notation for 5-methylindazol-2-ide;propane;rhenium?
The canonical SMILES for 5-methylindazol-2-ide;propane;rhenium is CCC.Cc1ccc2n[n-]cc2c1.[Re].
What is the InChIKey of 5-methylindazol-2-ide;propane;rhenium?
The InChIKey is UNLXLSUBAYNKTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N2.C3H8.Re/c1-6-2-3-8-7(4-6)5-9-10-8;1-3-2;/h2-5H,1H3;3H2,1-2H3;/q-1;;.
What are the key properties of 5-methylindazol-2-ide;propane;rhenium?
5-methylindazol-2-ide;propane;rhenium has a molecular weight of 361.46 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylindazol-2-ide;propane;rhenium is sourced from PubChem (CID 155590157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).