CID 139244220

C5H5N — CID 139244220

IUPAC—
SMILESC=C1[C]NC=C1
InChIInChI=1S/C5H5N/c1-5-2-3-6-4-5/h2-3,6H,1H2
InChIKeyRIAWVFNWAHNXRS-UHFFFAOYSA-N
MW79.10 g/mol
LogP0.70
Rot. Bonds

About CID 139244220

CID 139244220 (PubChem CID 139244220) has the molecular formula C5H5N and a molecular weight of 79.10 g/mol.

Molecular Properties

Compound NameCID 139244220
PubChem CID139244220
Molecular FormulaC5H5N
Molecular Weight79.10 g/mol
Exact Mass79.04
IUPAC Name—
SMILESC=C1[C]NC=C1
InChIInChI=1S/C5H5N/c1-5-2-3-6-4-5/h2-3,6H,1H2
InChIKeyRIAWVFNWAHNXRS-UHFFFAOYSA-N
XLogP0.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50079.10
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze CID 139244220 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 139244220?
The IUPAC name of CID 139244220 (CID 139244220) is not available.
What is the SMILES notation for CID 139244220?
The canonical SMILES for CID 139244220 is C=C1[C]NC=C1.
What is the InChIKey of CID 139244220?
The InChIKey is RIAWVFNWAHNXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N/c1-5-2-3-6-4-5/h2-3,6H,1H2.
What are the key properties of CID 139244220?
CID 139244220 has a molecular weight of 79.10 g/mol, XLogP of 0.70, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139244220 is sourced from PubChem (CID 139244220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).