azanylidyneazanium;naphthalene;tetrafluoroborate

C10H9BF4N2 — CID 87197923

IUPACazanylidyneazanium;naphthalene;tetrafluoroborate
SMILESF[B-](F)(F)F.N#[NH+].c1ccc2ccccc2c1
InChIInChI=1S/C10H8.BF4.N2/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3,4)5;1-2/h1-8H;;/q;-1;/p+1
InChIKeyYBCUJLTVQQYJNP-UHFFFAOYSA-O
MW244.00 g/mol
LogP2.42
Rot. Bonds

About azanylidyneazanium;naphthalene;tetrafluoroborate

azanylidyneazanium;naphthalene;tetrafluoroborate (PubChem CID 87197923) has the molecular formula C10H9BF4N2 and a molecular weight of 244.00 g/mol. Its IUPAC name is azanylidyneazanium;naphthalene;tetrafluoroborate.

Molecular Properties

Compound Nameazanylidyneazanium;naphthalene;tetrafluoroborate
PubChem CID87197923
Molecular FormulaC10H9BF4N2
Molecular Weight244.00 g/mol
Exact Mass244.08
IUPAC Nameazanylidyneazanium;naphthalene;tetrafluoroborate
SMILESF[B-](F)(F)F.N#[NH+].c1ccc2ccccc2c1
InChIInChI=1S/C10H8.BF4.N2/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3,4)5;1-2/h1-8H;;/q;-1;/p+1
InChIKeyYBCUJLTVQQYJNP-UHFFFAOYSA-O
XLogP2.42
TPSA47.59 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.00
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of azanylidyneazanium;naphthalene;tetrafluoroborate?
The IUPAC name of azanylidyneazanium;naphthalene;tetrafluoroborate (CID 87197923) is azanylidyneazanium;naphthalene;tetrafluoroborate.
What is the SMILES notation for azanylidyneazanium;naphthalene;tetrafluoroborate?
The canonical SMILES for azanylidyneazanium;naphthalene;tetrafluoroborate is F[B-](F)(F)F.N#[NH+].c1ccc2ccccc2c1.
What is the InChIKey of azanylidyneazanium;naphthalene;tetrafluoroborate?
The InChIKey is YBCUJLTVQQYJNP-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H8.BF4.N2/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3,4)5;1-2/h1-8H;;/q;-1;/p+1.
What are the key properties of azanylidyneazanium;naphthalene;tetrafluoroborate?
azanylidyneazanium;naphthalene;tetrafluoroborate has a molecular weight of 244.00 g/mol, XLogP of 2.42, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azanylidyneazanium;naphthalene;tetrafluoroborate is sourced from PubChem (CID 87197923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).