CID 59355565

C7H6N2 — CID 59355565

IUPAC—
SMILES[CH]c1ncnc(C)c1[CH]
InChIInChI=1S/C7H6N2/c1-5-6(2)8-4-9-7(5)3/h1-2,4H,3H3
InChIKeyRUJSYZVPYVQBFP-UHFFFAOYSA-N
MW118.14 g/mol
LogP0.90
Rot. Bonds

About CID 59355565

CID 59355565 (PubChem CID 59355565) has the molecular formula C7H6N2 and a molecular weight of 118.14 g/mol.

Molecular Properties

Compound NameCID 59355565
PubChem CID59355565
Molecular FormulaC7H6N2
Molecular Weight118.14 g/mol
Exact Mass118.05
IUPAC Name—
SMILES[CH]c1ncnc(C)c1[CH]
InChIInChI=1S/C7H6N2/c1-5-6(2)8-4-9-7(5)3/h1-2,4H,3H3
InChIKeyRUJSYZVPYVQBFP-UHFFFAOYSA-N
XLogP0.90
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.14
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze CID 59355565 with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 59355565?
The IUPAC name of CID 59355565 (CID 59355565) is not available.
What is the SMILES notation for CID 59355565?
The canonical SMILES for CID 59355565 is [CH]c1ncnc(C)c1[CH].
What is the InChIKey of CID 59355565?
The InChIKey is RUJSYZVPYVQBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2/c1-5-6(2)8-4-9-7(5)3/h1-2,4H,3H3.
What are the key properties of CID 59355565?
CID 59355565 has a molecular weight of 118.14 g/mol, XLogP of 0.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59355565 is sourced from PubChem (CID 59355565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).