1,3,5,2-triazaphosphinine

C2H2N3P — CID 19428710

IUPAC1,3,5,2-triazaphosphinine
SMILESc1ncnpn1
InChIInChI=1S/C2H2N3P/c1-3-2-5-6-4-1/h1-2H
InChIKeyZGQLHIRDBUGVJC-UHFFFAOYSA-N
MW99.03 g/mol
LogP0.45
Rot. Bonds

About 1,3,5,2-triazaphosphinine

1,3,5,2-triazaphosphinine (PubChem CID 19428710) has the molecular formula C2H2N3P and a molecular weight of 99.03 g/mol. Its IUPAC name is 1,3,5,2-triazaphosphinine.

Molecular Properties

Compound Name1,3,5,2-triazaphosphinine
PubChem CID19428710
Molecular FormulaC2H2N3P
Molecular Weight99.03 g/mol
Exact Mass99.00
IUPAC Name1,3,5,2-triazaphosphinine
SMILESc1ncnpn1
InChIInChI=1S/C2H2N3P/c1-3-2-5-6-4-1/h1-2H
InChIKeyZGQLHIRDBUGVJC-UHFFFAOYSA-N
XLogP0.45
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.03
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3,5,2-triazaphosphinine?
The IUPAC name of 1,3,5,2-triazaphosphinine (CID 19428710) is 1,3,5,2-triazaphosphinine.
What is the SMILES notation for 1,3,5,2-triazaphosphinine?
The canonical SMILES for 1,3,5,2-triazaphosphinine is c1ncnpn1.
What is the InChIKey of 1,3,5,2-triazaphosphinine?
The InChIKey is ZGQLHIRDBUGVJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2N3P/c1-3-2-5-6-4-1/h1-2H.
What are the key properties of 1,3,5,2-triazaphosphinine?
1,3,5,2-triazaphosphinine has a molecular weight of 99.03 g/mol, XLogP of 0.45, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5,2-triazaphosphinine is sourced from PubChem (CID 19428710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).