1-propan-2-ylsiletane

C6H14Si — CID 15134745

IUPAC1-propan-2-ylsiletane
SMILESCC(C)[SiH]1CCC1
InChIInChI=1S/C6H14Si/c1-6(2)7-4-3-5-7/h6-7H,3-5H2,1-2H3
InChIKeyXHSPQPPZSCMQMJ-UHFFFAOYSA-N
MW114.26 g/mol
LogP2.03
Rot. Bonds1

About 1-propan-2-ylsiletane

1-propan-2-ylsiletane (PubChem CID 15134745) has the molecular formula C6H14Si and a molecular weight of 114.26 g/mol. Its IUPAC name is 1-propan-2-ylsiletane.

Molecular Properties

Compound Name1-propan-2-ylsiletane
PubChem CID15134745
Molecular FormulaC6H14Si
Molecular Weight114.26 g/mol
Exact Mass114.09
IUPAC Name1-propan-2-ylsiletane
SMILESCC(C)[SiH]1CCC1
InChIInChI=1S/C6H14Si/c1-6(2)7-4-3-5-7/h6-7H,3-5H2,1-2H3
InChIKeyXHSPQPPZSCMQMJ-UHFFFAOYSA-N
XLogP2.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.26
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1-propan-2-ylsiletane 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 1-propan-2-ylsiletane?
The IUPAC name of 1-propan-2-ylsiletane (CID 15134745) is 1-propan-2-ylsiletane.
What is the SMILES notation for 1-propan-2-ylsiletane?
The canonical SMILES for 1-propan-2-ylsiletane is CC(C)[SiH]1CCC1.
What is the InChIKey of 1-propan-2-ylsiletane?
The InChIKey is XHSPQPPZSCMQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14Si/c1-6(2)7-4-3-5-7/h6-7H,3-5H2,1-2H3.
What are the key properties of 1-propan-2-ylsiletane?
1-propan-2-ylsiletane has a molecular weight of 114.26 g/mol, XLogP of 2.03, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-ylsiletane is sourced from PubChem (CID 15134745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).