CID 159233079

H9N3OP2 — CID 159233079

IUPAC—
SMILESNP(N)(N)=O.P
InChIInChI=1S/H6N3OP.H3P/c1-5(2,3)4;/h(H6,1,2,3,4);1H3
InChIKeyKTDISHMAKPRCQI-UHFFFAOYSA-N
MW129.04 g/mol
LogP-0.97
Rot. Bonds

About CID 159233079

CID 159233079 (PubChem CID 159233079) has the molecular formula H9N3OP2 and a molecular weight of 129.04 g/mol.

Molecular Properties

Compound NameCID 159233079
PubChem CID159233079
Molecular FormulaH9N3OP2
Molecular Weight129.04 g/mol
Exact Mass129.02
IUPAC Name—
SMILESNP(N)(N)=O.P
InChIInChI=1S/H6N3OP.H3P/c1-5(2,3)4;/h(H6,1,2,3,4);1H3
InChIKeyKTDISHMAKPRCQI-UHFFFAOYSA-N
XLogP-0.97
TPSA95.13 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.04
LogP ≤ 5-0.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

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 159233079?
The IUPAC name of CID 159233079 (CID 159233079) is not available.
What is the SMILES notation for CID 159233079?
The canonical SMILES for CID 159233079 is NP(N)(N)=O.P.
What is the InChIKey of CID 159233079?
The InChIKey is KTDISHMAKPRCQI-UHFFFAOYSA-N. The full InChI is InChI=1S/H6N3OP.H3P/c1-5(2,3)4;/h(H6,1,2,3,4);1H3.
What are the key properties of CID 159233079?
CID 159233079 has a molecular weight of 129.04 g/mol, XLogP of -0.97, 0 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159233079 is sourced from PubChem (CID 159233079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).