CID 19602010

C13H12F2N2Si — CID 19602010

IUPAC—
SMILESCCC[Si]c1cnc(-c2ccc(F)c(F)c2)nc1
InChIInChI=1S/C13H12F2N2Si/c1-2-5-18-10-7-16-13(17-8-10)9-3-4-11(14)12(15)6-9/h3-4,6-8H,2,5H2,1H3
InChIKeyLVQIEBNCOJQPRK-UHFFFAOYSA-N
MW262.34 g/mol
LogP2.58
Rot. Bonds4

About CID 19602010

CID 19602010 (PubChem CID 19602010) has the molecular formula C13H12F2N2Si and a molecular weight of 262.34 g/mol.

Molecular Properties

Compound NameCID 19602010
PubChem CID19602010
Molecular FormulaC13H12F2N2Si
Molecular Weight262.34 g/mol
Exact Mass262.07
IUPAC Name—
SMILESCCC[Si]c1cnc(-c2ccc(F)c(F)c2)nc1
InChIInChI=1S/C13H12F2N2Si/c1-2-5-18-10-7-16-13(17-8-10)9-3-4-11(14)12(15)6-9/h3-4,6-8H,2,5H2,1H3
InChIKeyLVQIEBNCOJQPRK-UHFFFAOYSA-N
XLogP2.58
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.34
LogP ≤ 52.58
H-Bond Donors ≤ 50
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 CID 19602010?
The IUPAC name of CID 19602010 (CID 19602010) is not available.
What is the SMILES notation for CID 19602010?
The canonical SMILES for CID 19602010 is CCC[Si]c1cnc(-c2ccc(F)c(F)c2)nc1.
What is the InChIKey of CID 19602010?
The InChIKey is LVQIEBNCOJQPRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F2N2Si/c1-2-5-18-10-7-16-13(17-8-10)9-3-4-11(14)12(15)6-9/h3-4,6-8H,2,5H2,1H3.
What are the key properties of CID 19602010?
CID 19602010 has a molecular weight of 262.34 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19602010 is sourced from PubChem (CID 19602010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).