CID 59937458

C2H5N2 — CID 59937458

IUPAC—
SMILES[CH2-]/[N+]=N/C
InChIInChI=1S/C2H5N2/c1-3-4-2/h1H2,2H3
InChIKeyXXTXMBBLXURDDX-UHFFFAOYSA-N
MW57.08 g/mol
LogP0.20
Rot. Bonds

About CID 59937458

CID 59937458 (PubChem CID 59937458) has the molecular formula C2H5N2 and a molecular weight of 57.08 g/mol.

Molecular Properties

Compound NameCID 59937458
PubChem CID59937458
Molecular FormulaC2H5N2
Molecular Weight57.08 g/mol
Exact Mass57.05
IUPAC Name—
SMILES[CH2-]/[N+]=N/C
InChIInChI=1S/C2H5N2/c1-3-4-2/h1H2,2H3
InChIKeyXXTXMBBLXURDDX-UHFFFAOYSA-N
XLogP0.20
TPSA26.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50057.08
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 59937458?
The IUPAC name of CID 59937458 (CID 59937458) is not available.
What is the SMILES notation for CID 59937458?
The canonical SMILES for CID 59937458 is [CH2-]/[N+]=N/C.
What is the InChIKey of CID 59937458?
The InChIKey is XXTXMBBLXURDDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5N2/c1-3-4-2/h1H2,2H3.
What are the key properties of CID 59937458?
CID 59937458 has a molecular weight of 57.08 g/mol, XLogP of 0.20, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59937458 is sourced from PubChem (CID 59937458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).