CID 18951477

C10H12N3OSi — CID 18951477

IUPAC—
SMILESN#CCCC(CCC#N)(CCC#N)O[Si]
InChIInChI=1S/C10H12N3OSi/c11-7-1-4-10(14-15,5-2-8-12)6-3-9-13/h1-6H2
InChIKeyWQYRTSPOVLKSKQ-UHFFFAOYSA-N
MW218.31 g/mol
LogP1.74
Rot. Bonds7

About CID 18951477

CID 18951477 (PubChem CID 18951477) has the molecular formula C10H12N3OSi and a molecular weight of 218.31 g/mol.

Molecular Properties

Compound NameCID 18951477
PubChem CID18951477
Molecular FormulaC10H12N3OSi
Molecular Weight218.31 g/mol
Exact Mass218.07
IUPAC Name—
SMILESN#CCCC(CCC#N)(CCC#N)O[Si]
InChIInChI=1S/C10H12N3OSi/c11-7-1-4-10(14-15,5-2-8-12)6-3-9-13/h1-6H2
InChIKeyWQYRTSPOVLKSKQ-UHFFFAOYSA-N
XLogP1.74
TPSA80.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.31
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 18951477?
The IUPAC name of CID 18951477 (CID 18951477) is not available.
What is the SMILES notation for CID 18951477?
The canonical SMILES for CID 18951477 is N#CCCC(CCC#N)(CCC#N)O[Si].
What is the InChIKey of CID 18951477?
The InChIKey is WQYRTSPOVLKSKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N3OSi/c11-7-1-4-10(14-15,5-2-8-12)6-3-9-13/h1-6H2.
What are the key properties of CID 18951477?
CID 18951477 has a molecular weight of 218.31 g/mol, XLogP of 1.74, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18951477 is sourced from PubChem (CID 18951477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).