formic acid;bis(pyridine)

C11H12N2O2 — CID 158008580

IUPACformic acid;bis(pyridine)
SMILESO=CO.c1ccncc1.c1ccncc1
InChIInChI=1S/2C5H5N.CH2O2/c2*1-2-4-6-5-3-1;2-1-3/h2*1-5H;1H,(H,2,3)
InChIKeyFEPKFOKTHYOWDN-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.86
Rot. Bonds

About formic acid;bis(pyridine)

formic acid;bis(pyridine) (PubChem CID 158008580) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is formic acid;bis(pyridine).

Molecular Properties

Compound Nameformic acid;bis(pyridine)
PubChem CID158008580
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Nameformic acid;bis(pyridine)
SMILESO=CO.c1ccncc1.c1ccncc1
InChIInChI=1S/2C5H5N.CH2O2/c2*1-2-4-6-5-3-1;2-1-3/h2*1-5H;1H,(H,2,3)
InChIKeyFEPKFOKTHYOWDN-UHFFFAOYSA-N
XLogP1.86
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze formic acid;bis(pyridine) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methanethioic S-acid;pyridine
CID 163488022
1,5-diazecine
CID 53440348
pyridine
CID 67755510
pyridine
CID 160878650
but-2-enedioic acid;bis(pyridine)
CID 173055227
arsinous acid;pyridine
CID 174645427
tetrakis(pyridine);silicic acid
CID 172745480
pyridine;titanium
CID 87570870
cobalt(2+);bis(pyridine)
CID 71357223
pyrazine;bis(pyridine)
CID 159366306
cadmium(2+);pyridine;chloride
CID 21144711
iridium(3+);tris(pyridine)
CID 22020171

Frequently Asked Questions

What is the IUPAC name of formic acid;bis(pyridine)?
The IUPAC name of formic acid;bis(pyridine) (CID 158008580) is formic acid;bis(pyridine).
What is the SMILES notation for formic acid;bis(pyridine)?
The canonical SMILES for formic acid;bis(pyridine) is O=CO.c1ccncc1.c1ccncc1.
What is the InChIKey of formic acid;bis(pyridine)?
The InChIKey is FEPKFOKTHYOWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H5N.CH2O2/c2*1-2-4-6-5-3-1;2-1-3/h2*1-5H;1H,(H,2,3).
What are the key properties of formic acid;bis(pyridine)?
formic acid;bis(pyridine) has a molecular weight of 204.23 g/mol, XLogP of 1.86, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formic acid;bis(pyridine) is sourced from PubChem (CID 158008580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).