CID 173374970

C7H11NO3Si — CID 173374970

IUPAC—
SMILESCCOC(=O)NC=C(C)C(=O)[SiH]
InChIInChI=1S/C7H11NO3Si/c1-3-11-7(10)8-4-5(2)6(9)12/h4,12H,3H2,1-2H3,(H,8,10)
InChIKeyVSVYBEVAKQBNIS-UHFFFAOYSA-N
MW185.25 g/mol
LogP0.06
Rot. Bonds3

About CID 173374970

CID 173374970 (PubChem CID 173374970) has the molecular formula C7H11NO3Si and a molecular weight of 185.25 g/mol.

Molecular Properties

Compound NameCID 173374970
PubChem CID173374970
Molecular FormulaC7H11NO3Si
Molecular Weight185.25 g/mol
Exact Mass185.05
IUPAC Name—
SMILESCCOC(=O)NC=C(C)C(=O)[SiH]
InChIInChI=1S/C7H11NO3Si/c1-3-11-7(10)8-4-5(2)6(9)12/h4,12H,3H2,1-2H3,(H,8,10)
InChIKeyVSVYBEVAKQBNIS-UHFFFAOYSA-N
XLogP0.06
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.25
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 173374970?
The IUPAC name of CID 173374970 (CID 173374970) is not available.
What is the SMILES notation for CID 173374970?
The canonical SMILES for CID 173374970 is CCOC(=O)NC=C(C)C(=O)[SiH].
What is the InChIKey of CID 173374970?
The InChIKey is VSVYBEVAKQBNIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO3Si/c1-3-11-7(10)8-4-5(2)6(9)12/h4,12H,3H2,1-2H3,(H,8,10).
What are the key properties of CID 173374970?
CID 173374970 has a molecular weight of 185.25 g/mol, XLogP of 0.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173374970 is sourced from PubChem (CID 173374970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).