CID 88606118

C7H17NOSi — CID 88606118

IUPAC—
SMILESCCO[Si]CN(CC)CC
InChIInChI=1S/C7H17NOSi/c1-4-8(5-2)7-10-9-6-3/h4-7H2,1-3H3
InChIKeyJTQKAKAFSHQEEU-UHFFFAOYSA-N
MW159.30 g/mol
LogP0.94
Rot. Bonds6

About CID 88606118

CID 88606118 (PubChem CID 88606118) has the molecular formula C7H17NOSi and a molecular weight of 159.30 g/mol.

Molecular Properties

Compound NameCID 88606118
PubChem CID88606118
Molecular FormulaC7H17NOSi
Molecular Weight159.30 g/mol
Exact Mass159.11
IUPAC Name—
SMILESCCO[Si]CN(CC)CC
InChIInChI=1S/C7H17NOSi/c1-4-8(5-2)7-10-9-6-3/h4-7H2,1-3H3
InChIKeyJTQKAKAFSHQEEU-UHFFFAOYSA-N
XLogP0.94
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.30
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze CID 88606118 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 88606118?
The IUPAC name of CID 88606118 (CID 88606118) is not available.
What is the SMILES notation for CID 88606118?
The canonical SMILES for CID 88606118 is CCO[Si]CN(CC)CC.
What is the InChIKey of CID 88606118?
The InChIKey is JTQKAKAFSHQEEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NOSi/c1-4-8(5-2)7-10-9-6-3/h4-7H2,1-3H3.
What are the key properties of CID 88606118?
CID 88606118 has a molecular weight of 159.30 g/mol, XLogP of 0.94, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88606118 is sourced from PubChem (CID 88606118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).