CID 174388851

H5NO2P2 — CID 174388851

IUPAC—
SMILESNP.O=PO
InChIInChI=1S/H4NP.HO2P/c1-2;1-3-2/h1-2H2;(H,1,2)
InChIKeyIOACOLRGCMXQBB-UHFFFAOYSA-N
MW112.99 g/mol
LogP-0.08
Rot. Bonds

About CID 174388851

CID 174388851 (PubChem CID 174388851) has the molecular formula H5NO2P2 and a molecular weight of 112.99 g/mol.

Molecular Properties

Compound NameCID 174388851
PubChem CID174388851
Molecular FormulaH5NO2P2
Molecular Weight112.99 g/mol
Exact Mass112.98
IUPAC Name—
SMILESNP.O=PO
InChIInChI=1S/H4NP.HO2P/c1-2;1-3-2/h1-2H2;(H,1,2)
InChIKeyIOACOLRGCMXQBB-UHFFFAOYSA-N
XLogP-0.08
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.99
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 174388851?
The IUPAC name of CID 174388851 (CID 174388851) is not available.
What is the SMILES notation for CID 174388851?
The canonical SMILES for CID 174388851 is NP.O=PO.
What is the InChIKey of CID 174388851?
The InChIKey is IOACOLRGCMXQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/H4NP.HO2P/c1-2;1-3-2/h1-2H2;(H,1,2).
What are the key properties of CID 174388851?
CID 174388851 has a molecular weight of 112.99 g/mol, XLogP of -0.08, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174388851 is sourced from PubChem (CID 174388851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).