isocyanic acid;methane;silane

C4H14N2O2Si — CID 173153072

IUPACisocyanic acid;methane;silane
SMILESC.C.N=C=O.N=C=O.[SiH4]
InChIInChI=1S/2CHNO.2CH4.H4Si/c2*2-1-3;;;/h2*2H;3*1H4
InChIKeyPNPMKGQLLSVRIH-UHFFFAOYSA-N
MW150.25 g/mol
LogP-0.38
Rot. Bonds

About isocyanic acid;methane;silane

isocyanic acid;methane;silane (PubChem CID 173153072) has the molecular formula C4H14N2O2Si and a molecular weight of 150.25 g/mol. Its IUPAC name is isocyanic acid;methane;silane.

Molecular Properties

Compound Nameisocyanic acid;methane;silane
PubChem CID173153072
Molecular FormulaC4H14N2O2Si
Molecular Weight150.25 g/mol
Exact Mass150.08
IUPAC Nameisocyanic acid;methane;silane
SMILESC.C.N=C=O.N=C=O.[SiH4]
InChIInChI=1S/2CHNO.2CH4.H4Si/c2*2-1-3;;;/h2*2H;3*1H4
InChIKeyPNPMKGQLLSVRIH-UHFFFAOYSA-N
XLogP-0.38
TPSA81.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.25
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of isocyanic acid;methane;silane?
The IUPAC name of isocyanic acid;methane;silane (CID 173153072) is isocyanic acid;methane;silane.
What is the SMILES notation for isocyanic acid;methane;silane?
The canonical SMILES for isocyanic acid;methane;silane is C.C.N=C=O.N=C=O.[SiH4].
What is the InChIKey of isocyanic acid;methane;silane?
The InChIKey is PNPMKGQLLSVRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/2CHNO.2CH4.H4Si/c2*2-1-3;;;/h2*2H;3*1H4.
What are the key properties of isocyanic acid;methane;silane?
isocyanic acid;methane;silane has a molecular weight of 150.25 g/mol, XLogP of -0.38, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for isocyanic acid;methane;silane is sourced from PubChem (CID 173153072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).