CID 174278434

C11H10NO2Si — CID 174278434

IUPAC—
SMILESCc1cc2c(c(C)c1C)C(=O)N([Si])C2=O
InChIInChI=1S/C11H10NO2Si/c1-5-4-8-9(7(3)6(5)2)11(14)12(15)10(8)13/h4H,1-3H3
InChIKeyIDIOJLHQBMQYRN-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.29
Rot. Bonds

About CID 174278434

CID 174278434 (PubChem CID 174278434) has the molecular formula C11H10NO2Si and a molecular weight of 216.29 g/mol.

Molecular Properties

Compound NameCID 174278434
PubChem CID174278434
Molecular FormulaC11H10NO2Si
Molecular Weight216.29 g/mol
Exact Mass216.05
IUPAC Name—
SMILESCc1cc2c(c(C)c1C)C(=O)N([Si])C2=O
InChIInChI=1S/C11H10NO2Si/c1-5-4-8-9(7(3)6(5)2)11(14)12(15)10(8)13/h4H,1-3H3
InChIKeyIDIOJLHQBMQYRN-UHFFFAOYSA-N
XLogP1.29
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 174278434?
The IUPAC name of CID 174278434 (CID 174278434) is not available.
What is the SMILES notation for CID 174278434?
The canonical SMILES for CID 174278434 is Cc1cc2c(c(C)c1C)C(=O)N([Si])C2=O.
What is the InChIKey of CID 174278434?
The InChIKey is IDIOJLHQBMQYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10NO2Si/c1-5-4-8-9(7(3)6(5)2)11(14)12(15)10(8)13/h4H,1-3H3.
What are the key properties of CID 174278434?
CID 174278434 has a molecular weight of 216.29 g/mol, XLogP of 1.29, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174278434 is sourced from PubChem (CID 174278434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).