CID 67276744

C10H11ClNSi — CID 67276744

IUPAC—
SMILESC=C([Si])c1cccc(Cl)c1NCC
InChIInChI=1S/C10H11ClNSi/c1-3-12-10-8(7(2)13)5-4-6-9(10)11/h4-6,12H,2-3H2,1H3
InChIKeyZRCFFVQMVNGWGK-UHFFFAOYSA-N
MW208.74 g/mol
LogP2.91
Rot. Bonds3

About CID 67276744

CID 67276744 (PubChem CID 67276744) has the molecular formula C10H11ClNSi and a molecular weight of 208.74 g/mol.

Molecular Properties

Compound NameCID 67276744
PubChem CID67276744
Molecular FormulaC10H11ClNSi
Molecular Weight208.74 g/mol
Exact Mass208.03
IUPAC Name—
SMILESC=C([Si])c1cccc(Cl)c1NCC
InChIInChI=1S/C10H11ClNSi/c1-3-12-10-8(7(2)13)5-4-6-9(10)11/h4-6,12H,2-3H2,1H3
InChIKeyZRCFFVQMVNGWGK-UHFFFAOYSA-N
XLogP2.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.74
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 67276744?
The IUPAC name of CID 67276744 (CID 67276744) is not available.
What is the SMILES notation for CID 67276744?
The canonical SMILES for CID 67276744 is C=C([Si])c1cccc(Cl)c1NCC.
What is the InChIKey of CID 67276744?
The InChIKey is ZRCFFVQMVNGWGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClNSi/c1-3-12-10-8(7(2)13)5-4-6-9(10)11/h4-6,12H,2-3H2,1H3.
What are the key properties of CID 67276744?
CID 67276744 has a molecular weight of 208.74 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67276744 is sourced from PubChem (CID 67276744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).