2-deuterioethenylideneazanide

C2HN — CID 100930729

IUPAC2-deuterioethenylideneazanide
SMILES[2H][C+]=C=[N-]
InChIInChI=1S/C2HN/c1-2-3/h1H/i1D
InChIKeySZICEGNEOSKVLO-MICDWDOJSA-N
MW40.04 g/mol
LogP0.21
Rot. Bonds

About 2-deuterioethenylideneazanide

2-deuterioethenylideneazanide (PubChem CID 100930729) has the molecular formula C2HN and a molecular weight of 40.04 g/mol. Its IUPAC name is 2-deuterioethenylideneazanide.

Molecular Properties

Compound Name2-deuterioethenylideneazanide
PubChem CID100930729
Molecular FormulaC2HN
Molecular Weight40.04 g/mol
Exact Mass40.02
IUPAC Name2-deuterioethenylideneazanide
SMILES[2H][C+]=C=[N-]
InChIInChI=1S/C2HN/c1-2-3/h1H/i1D
InChIKeySZICEGNEOSKVLO-MICDWDOJSA-N
XLogP0.21
TPSA22.30 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50040.04
LogP ≤ 50.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-deuterioethenylideneazanide?
The IUPAC name of 2-deuterioethenylideneazanide (CID 100930729) is 2-deuterioethenylideneazanide.
What is the SMILES notation for 2-deuterioethenylideneazanide?
The canonical SMILES for 2-deuterioethenylideneazanide is [2H][C+]=C=[N-].
What is the InChIKey of 2-deuterioethenylideneazanide?
The InChIKey is SZICEGNEOSKVLO-MICDWDOJSA-N. The full InChI is InChI=1S/C2HN/c1-2-3/h1H/i1D.
What are the key properties of 2-deuterioethenylideneazanide?
2-deuterioethenylideneazanide has a molecular weight of 40.04 g/mol, XLogP of 0.21, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-deuterioethenylideneazanide is sourced from PubChem (CID 100930729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).