CID 58754972

C2H4N2 — CID 58754972

IUPAC—
SMILES[H]/N=C(\[CH])N
InChIInChI=1S/C2H4N2/c1-2(3)4/h1H,(H3,3,4)
InChIKeyLWXBCZUQDTXERL-UHFFFAOYSA-N
MW56.07 g/mol
LogP-0.37
Rot. Bonds

About CID 58754972

CID 58754972 (PubChem CID 58754972) has the molecular formula C2H4N2 and a molecular weight of 56.07 g/mol.

Molecular Properties

Compound NameCID 58754972
PubChem CID58754972
Molecular FormulaC2H4N2
Molecular Weight56.07 g/mol
Exact Mass56.04
IUPAC Name—
SMILES[H]/N=C(\[CH])N
InChIInChI=1S/C2H4N2/c1-2(3)4/h1H,(H3,3,4)
InChIKeyLWXBCZUQDTXERL-UHFFFAOYSA-N
XLogP-0.37
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50056.07
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 58754972?
The IUPAC name of CID 58754972 (CID 58754972) is not available.
What is the SMILES notation for CID 58754972?
The canonical SMILES for CID 58754972 is [H]/N=C(\[CH])N.
What is the InChIKey of CID 58754972?
The InChIKey is LWXBCZUQDTXERL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4N2/c1-2(3)4/h1H,(H3,3,4).
What are the key properties of CID 58754972?
CID 58754972 has a molecular weight of 56.07 g/mol, XLogP of -0.37, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58754972 is sourced from PubChem (CID 58754972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).