CID 145297896

C12H24N2Si- — CID 145297896

IUPAC—
SMILESC=CC(=C)C[Si-](C)(C)N1CCN(C)CC1
InChIInChI=1S/C12H24N2Si/c1-6-12(2)11-15(4,5)14-9-7-13(3)8-10-14/h6H,1-2,7-11H2,3-5H3/q-1
InChIKeyKZFKPOMRDWTPRT-UHFFFAOYSA-N
MW224.42 g/mol
LogP2.18
Rot. Bonds4

About CID 145297896

CID 145297896 (PubChem CID 145297896) has the molecular formula C12H24N2Si- and a molecular weight of 224.42 g/mol.

Molecular Properties

Compound NameCID 145297896
PubChem CID145297896
Molecular FormulaC12H24N2Si-
Molecular Weight224.42 g/mol
Exact Mass224.17
IUPAC Name—
SMILESC=CC(=C)C[Si-](C)(C)N1CCN(C)CC1
InChIInChI=1S/C12H24N2Si/c1-6-12(2)11-15(4,5)14-9-7-13(3)8-10-14/h6H,1-2,7-11H2,3-5H3/q-1
InChIKeyKZFKPOMRDWTPRT-UHFFFAOYSA-N
XLogP2.18
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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1-[(4E)-5,6-dichloro-3-methylidenehepta-4,6-dienyl]-4-methylpiperazine
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Frequently Asked Questions

What is the IUPAC name of CID 145297896?
The IUPAC name of CID 145297896 (CID 145297896) is not available.
What is the SMILES notation for CID 145297896?
The canonical SMILES for CID 145297896 is C=CC(=C)C[Si-](C)(C)N1CCN(C)CC1.
What is the InChIKey of CID 145297896?
The InChIKey is KZFKPOMRDWTPRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2Si/c1-6-12(2)11-15(4,5)14-9-7-13(3)8-10-14/h6H,1-2,7-11H2,3-5H3/q-1.
What are the key properties of CID 145297896?
CID 145297896 has a molecular weight of 224.42 g/mol, XLogP of 2.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 145297896 is sourced from PubChem (CID 145297896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).