CID 10756049

C16H24SiTi+2 — CID 10756049

IUPAC—
SMILES[CH2-][Si](C)(C)C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[H][C-]=C.[Ti+4]
InChIInChI=1S/2C5H5.C4H11Si.C2H3.Ti/c2*1-2-4-5-3-1;1-5(2,3)4;1-2;/h2*1-5H;1H2,2-4H3;1H,2H2;/q;;2*-1;+4
InChIKeySUOCNUVHDOOKTG-UHFFFAOYSA-N
MW292.32 g/mol
LogP4.34
Rot. Bonds

About CID 10756049

CID 10756049 (PubChem CID 10756049) has the molecular formula C16H24SiTi+2 and a molecular weight of 292.32 g/mol.

Molecular Properties

Compound NameCID 10756049
PubChem CID10756049
Molecular FormulaC16H24SiTi+2
Molecular Weight292.32 g/mol
Exact Mass292.11
IUPAC Name—
SMILES[CH2-][Si](C)(C)C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[H][C-]=C.[Ti+4]
InChIInChI=1S/2C5H5.C4H11Si.C2H3.Ti/c2*1-2-4-5-3-1;1-5(2,3)4;1-2;/h2*1-5H;1H2,2-4H3;1H,2H2;/q;;2*-1;+4
InChIKeySUOCNUVHDOOKTG-UHFFFAOYSA-N
XLogP4.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.32
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 10756049 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 10756049?
The IUPAC name of CID 10756049 (CID 10756049) is not available.
What is the SMILES notation for CID 10756049?
The canonical SMILES for CID 10756049 is [CH2-][Si](C)(C)C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[H][C-]=C.[Ti+4].
What is the InChIKey of CID 10756049?
The InChIKey is SUOCNUVHDOOKTG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H5.C4H11Si.C2H3.Ti/c2*1-2-4-5-3-1;1-5(2,3)4;1-2;/h2*1-5H;1H2,2-4H3;1H,2H2;/q;;2*-1;+4.
What are the key properties of CID 10756049?
CID 10756049 has a molecular weight of 292.32 g/mol, XLogP of 4.34, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10756049 is sourced from PubChem (CID 10756049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).