3-N-silylidenebenzene-1,3-dicarboxamide

C8H8N2O2Si — CID 151843827

IUPAC3-N-silylidenebenzene-1,3-dicarboxamide
SMILESNC(=O)c1cccc(C(=O)N=[SiH2])c1
InChIInChI=1S/C8H8N2O2Si/c9-7(11)5-2-1-3-6(4-5)8(12)10-13/h1-4H,13H2,(H2,9,11)
InChIKeySHFOTEHXDYRXTA-UHFFFAOYSA-N
MW192.25 g/mol
LogP-0.26
Rot. Bonds2

About 3-N-silylidenebenzene-1,3-dicarboxamide

3-N-silylidenebenzene-1,3-dicarboxamide (PubChem CID 151843827) has the molecular formula C8H8N2O2Si and a molecular weight of 192.25 g/mol. Its IUPAC name is 3-N-silylidenebenzene-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-silylidenebenzene-1,3-dicarboxamide
PubChem CID151843827
Molecular FormulaC8H8N2O2Si
Molecular Weight192.25 g/mol
Exact Mass192.04
IUPAC Name3-N-silylidenebenzene-1,3-dicarboxamide
SMILESNC(=O)c1cccc(C(=O)N=[SiH2])c1
InChIInChI=1S/C8H8N2O2Si/c9-7(11)5-2-1-3-6(4-5)8(12)10-13/h1-4H,13H2,(H2,9,11)
InChIKeySHFOTEHXDYRXTA-UHFFFAOYSA-N
XLogP-0.26
TPSA72.52 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.25
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-N-silylidenebenzene-1,3-dicarboxamide?
The IUPAC name of 3-N-silylidenebenzene-1,3-dicarboxamide (CID 151843827) is 3-N-silylidenebenzene-1,3-dicarboxamide.
What is the SMILES notation for 3-N-silylidenebenzene-1,3-dicarboxamide?
The canonical SMILES for 3-N-silylidenebenzene-1,3-dicarboxamide is NC(=O)c1cccc(C(=O)N=[SiH2])c1.
What is the InChIKey of 3-N-silylidenebenzene-1,3-dicarboxamide?
The InChIKey is SHFOTEHXDYRXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2Si/c9-7(11)5-2-1-3-6(4-5)8(12)10-13/h1-4H,13H2,(H2,9,11).
What are the key properties of 3-N-silylidenebenzene-1,3-dicarboxamide?
3-N-silylidenebenzene-1,3-dicarboxamide has a molecular weight of 192.25 g/mol, XLogP of -0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-silylidenebenzene-1,3-dicarboxamide is sourced from PubChem (CID 151843827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).