2-(1-propylsilinan-4-yl)acetaldehyde

C10H20OSi — CID 154079942

IUPAC2-(1-propylsilinan-4-yl)acetaldehyde
SMILESCCC[SiH]1CCC(CC=O)CC1
InChIInChI=1S/C10H20OSi/c1-2-7-12-8-4-10(3-6-11)5-9-12/h6,10,12H,2-5,7-9H2,1H3
InChIKeyUVTQPNOAHSTXBV-UHFFFAOYSA-N
MW184.35 g/mol
LogP2.62
Rot. Bonds4

About 2-(1-propylsilinan-4-yl)acetaldehyde

2-(1-propylsilinan-4-yl)acetaldehyde (PubChem CID 154079942) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is 2-(1-propylsilinan-4-yl)acetaldehyde.

Molecular Properties

Compound Name2-(1-propylsilinan-4-yl)acetaldehyde
PubChem CID154079942
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name2-(1-propylsilinan-4-yl)acetaldehyde
SMILESCCC[SiH]1CCC(CC=O)CC1
InChIInChI=1S/C10H20OSi/c1-2-7-12-8-4-10(3-6-11)5-9-12/h6,10,12H,2-5,7-9H2,1H3
InChIKeyUVTQPNOAHSTXBV-UHFFFAOYSA-N
XLogP2.62
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-(1-propylsilinan-4-yl)acetaldehyde 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 2-(1-propylsilinan-4-yl)acetaldehyde?
The IUPAC name of 2-(1-propylsilinan-4-yl)acetaldehyde (CID 154079942) is 2-(1-propylsilinan-4-yl)acetaldehyde.
What is the SMILES notation for 2-(1-propylsilinan-4-yl)acetaldehyde?
The canonical SMILES for 2-(1-propylsilinan-4-yl)acetaldehyde is CCC[SiH]1CCC(CC=O)CC1.
What is the InChIKey of 2-(1-propylsilinan-4-yl)acetaldehyde?
The InChIKey is UVTQPNOAHSTXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20OSi/c1-2-7-12-8-4-10(3-6-11)5-9-12/h6,10,12H,2-5,7-9H2,1H3.
What are the key properties of 2-(1-propylsilinan-4-yl)acetaldehyde?
2-(1-propylsilinan-4-yl)acetaldehyde has a molecular weight of 184.35 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propylsilinan-4-yl)acetaldehyde is sourced from PubChem (CID 154079942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).