3-chlorooxadisilinan-3-amine

C3H10ClNOSi2 — CID 174961512

IUPAC3-chlorooxadisilinan-3-amine
SMILESN[Si]1(Cl)CCCO[SiH2]1
InChIInChI=1S/C3H10ClNOSi2/c4-8(5)3-1-2-6-7-8/h1-3,5,7H2
InChIKeyFVJRWFIOFABTJA-UHFFFAOYSA-N
MW167.74 g/mol
LogP-0.37
Rot. Bonds

About 3-chlorooxadisilinan-3-amine

3-chlorooxadisilinan-3-amine (PubChem CID 174961512) has the molecular formula C3H10ClNOSi2 and a molecular weight of 167.74 g/mol. Its IUPAC name is 3-chlorooxadisilinan-3-amine.

Molecular Properties

Compound Name3-chlorooxadisilinan-3-amine
PubChem CID174961512
Molecular FormulaC3H10ClNOSi2
Molecular Weight167.74 g/mol
Exact Mass167.00
IUPAC Name3-chlorooxadisilinan-3-amine
SMILESN[Si]1(Cl)CCCO[SiH2]1
InChIInChI=1S/C3H10ClNOSi2/c4-8(5)3-1-2-6-7-8/h1-3,5,7H2
InChIKeyFVJRWFIOFABTJA-UHFFFAOYSA-N
XLogP-0.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.74
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-chlorooxadisilinan-3-amine 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-chlorooxadisilinan-3-amine?
The IUPAC name of 3-chlorooxadisilinan-3-amine (CID 174961512) is 3-chlorooxadisilinan-3-amine.
What is the SMILES notation for 3-chlorooxadisilinan-3-amine?
The canonical SMILES for 3-chlorooxadisilinan-3-amine is N[Si]1(Cl)CCCO[SiH2]1.
What is the InChIKey of 3-chlorooxadisilinan-3-amine?
The InChIKey is FVJRWFIOFABTJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10ClNOSi2/c4-8(5)3-1-2-6-7-8/h1-3,5,7H2.
What are the key properties of 3-chlorooxadisilinan-3-amine?
3-chlorooxadisilinan-3-amine has a molecular weight of 167.74 g/mol, XLogP of -0.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chlorooxadisilinan-3-amine is sourced from PubChem (CID 174961512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).