CID 87937782

C16H15BiN2 — CID 87937782

IUPAC—
SMILES[Bi]c1ccccc1.c1ccncc1.c1ccncc1
InChIInChI=1S/C6H5.2C5H5N.Bi/c3*1-2-4-6-5-3-1;/h3*1-5H;
InChIKeyFJIUHCYALOVYPR-UHFFFAOYSA-N
MW444.29 g/mol
LogP2.64
Rot. Bonds

About CID 87937782

CID 87937782 (PubChem CID 87937782) has the molecular formula C16H15BiN2 and a molecular weight of 444.29 g/mol.

Molecular Properties

Compound NameCID 87937782
PubChem CID87937782
Molecular FormulaC16H15BiN2
Molecular Weight444.29 g/mol
Exact Mass444.10
IUPAC Name—
SMILES[Bi]c1ccccc1.c1ccncc1.c1ccncc1
InChIInChI=1S/C6H5.2C5H5N.Bi/c3*1-2-4-6-5-3-1;/h3*1-5H;
InChIKeyFJIUHCYALOVYPR-UHFFFAOYSA-N
XLogP2.64
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.29
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 87937782?
The IUPAC name of CID 87937782 (CID 87937782) is not available.
What is the SMILES notation for CID 87937782?
The canonical SMILES for CID 87937782 is [Bi]c1ccccc1.c1ccncc1.c1ccncc1.
What is the InChIKey of CID 87937782?
The InChIKey is FJIUHCYALOVYPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5.2C5H5N.Bi/c3*1-2-4-6-5-3-1;/h3*1-5H;.
What are the key properties of CID 87937782?
CID 87937782 has a molecular weight of 444.29 g/mol, XLogP of 2.64, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87937782 is sourced from PubChem (CID 87937782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).