1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine

C8H18INSi — CID 174009095

IUPAC1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine
SMILESCC(C)C1C[Si](C)(C)CN1I
InChIInChI=1S/C8H18INSi/c1-7(2)8-5-11(3,4)6-10(8)9/h7-8H,5-6H2,1-4H3
InChIKeyLSNIENKXWXDADX-UHFFFAOYSA-N
MW283.23 g/mol
LogP2.92
Rot. Bonds1

About 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine

1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine (PubChem CID 174009095) has the molecular formula C8H18INSi and a molecular weight of 283.23 g/mol. Its IUPAC name is 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine.

Molecular Properties

Compound Name1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine
PubChem CID174009095
Molecular FormulaC8H18INSi
Molecular Weight283.23 g/mol
Exact Mass283.03
IUPAC Name1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine
SMILESCC(C)C1C[Si](C)(C)CN1I
InChIInChI=1S/C8H18INSi/c1-7(2)8-5-11(3,4)6-10(8)9/h7-8H,5-6H2,1-4H3
InChIKeyLSNIENKXWXDADX-UHFFFAOYSA-N
XLogP2.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.23
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine?
The IUPAC name of 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine (CID 174009095) is 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine.
What is the SMILES notation for 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine?
The canonical SMILES for 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine is CC(C)C1C[Si](C)(C)CN1I.
What is the InChIKey of 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine?
The InChIKey is LSNIENKXWXDADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18INSi/c1-7(2)8-5-11(3,4)6-10(8)9/h7-8H,5-6H2,1-4H3.
What are the key properties of 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine?
1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine has a molecular weight of 283.23 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodo-3,3-dimethyl-5-propan-2-yl-1,3-azasilolidine is sourced from PubChem (CID 174009095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).