pyridine;quinazoline;hydrofluoride

C13H12FN3 — CID 159567796

IUPACpyridine;quinazoline;hydrofluoride
SMILESF.c1ccc2ncncc2c1.c1ccncc1
InChIInChI=1S/C8H6N2.C5H5N.FH/c1-2-4-8-7(3-1)5-9-6-10-8;1-2-4-6-5-3-1;/h1-6H;1-5H;1H
InChIKeyBTXXCXNAUZJHMM-UHFFFAOYSA-N
MW229.26 g/mol
LogP2.86
Rot. Bonds

About pyridine;quinazoline;hydrofluoride

pyridine;quinazoline;hydrofluoride (PubChem CID 159567796) has the molecular formula C13H12FN3 and a molecular weight of 229.26 g/mol. Its IUPAC name is pyridine;quinazoline;hydrofluoride.

Molecular Properties

Compound Namepyridine;quinazoline;hydrofluoride
PubChem CID159567796
Molecular FormulaC13H12FN3
Molecular Weight229.26 g/mol
Exact Mass229.10
IUPAC Namepyridine;quinazoline;hydrofluoride
SMILESF.c1ccc2ncncc2c1.c1ccncc1
InChIInChI=1S/C8H6N2.C5H5N.FH/c1-2-4-8-7(3-1)5-9-6-10-8;1-2-4-6-5-3-1;/h1-6H;1-5H;1H
InChIKeyBTXXCXNAUZJHMM-UHFFFAOYSA-N
XLogP2.86
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of pyridine;quinazoline;hydrofluoride?
The IUPAC name of pyridine;quinazoline;hydrofluoride (CID 159567796) is pyridine;quinazoline;hydrofluoride.
What is the SMILES notation for pyridine;quinazoline;hydrofluoride?
The canonical SMILES for pyridine;quinazoline;hydrofluoride is F.c1ccc2ncncc2c1.c1ccncc1.
What is the InChIKey of pyridine;quinazoline;hydrofluoride?
The InChIKey is BTXXCXNAUZJHMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2.C5H5N.FH/c1-2-4-8-7(3-1)5-9-6-10-8;1-2-4-6-5-3-1;/h1-6H;1-5H;1H.
What are the key properties of pyridine;quinazoline;hydrofluoride?
pyridine;quinazoline;hydrofluoride has a molecular weight of 229.26 g/mol, XLogP of 2.86, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine;quinazoline;hydrofluoride is sourced from PubChem (CID 159567796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).