3-azidopropyl-dichloro-methylsilane

C4H9Cl2N3Si — CID 141255183

IUPAC3-azidopropyl-dichloro-methylsilane
SMILESC[Si](Cl)(Cl)CCCN=[N+]=[N-]
InChIInChI=1S/C4H9Cl2N3Si/c1-10(5,6)4-2-3-8-9-7/h2-4H2,1H3
InChIKeySRRYXVYVYWWXRG-UHFFFAOYSA-N
MW198.13 g/mol
LogP3.24
Rot. Bonds4

About 3-azidopropyl-dichloro-methylsilane

3-azidopropyl-dichloro-methylsilane (PubChem CID 141255183) has the molecular formula C4H9Cl2N3Si and a molecular weight of 198.13 g/mol. Its IUPAC name is 3-azidopropyl-dichloro-methylsilane.

Molecular Properties

Compound Name3-azidopropyl-dichloro-methylsilane
PubChem CID141255183
Molecular FormulaC4H9Cl2N3Si
Molecular Weight198.13 g/mol
Exact Mass196.99
IUPAC Name3-azidopropyl-dichloro-methylsilane
SMILESC[Si](Cl)(Cl)CCCN=[N+]=[N-]
InChIInChI=1S/C4H9Cl2N3Si/c1-10(5,6)4-2-3-8-9-7/h2-4H2,1H3
InChIKeySRRYXVYVYWWXRG-UHFFFAOYSA-N
XLogP3.24
TPSA48.76 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.13
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 3-azidopropyl-dichloro-methylsilane 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 3-azidopropyl-dichloro-methylsilane?
The IUPAC name of 3-azidopropyl-dichloro-methylsilane (CID 141255183) is 3-azidopropyl-dichloro-methylsilane.
What is the SMILES notation for 3-azidopropyl-dichloro-methylsilane?
The canonical SMILES for 3-azidopropyl-dichloro-methylsilane is C[Si](Cl)(Cl)CCCN=[N+]=[N-].
What is the InChIKey of 3-azidopropyl-dichloro-methylsilane?
The InChIKey is SRRYXVYVYWWXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9Cl2N3Si/c1-10(5,6)4-2-3-8-9-7/h2-4H2,1H3.
What are the key properties of 3-azidopropyl-dichloro-methylsilane?
3-azidopropyl-dichloro-methylsilane has a molecular weight of 198.13 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azidopropyl-dichloro-methylsilane is sourced from PubChem (CID 141255183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).