CID 22982947

C12H25N2Si — CID 22982947

IUPAC—
SMILESCC1(C)CC(NCCC[Si])CC(C)(C)N1
InChIInChI=1S/C12H25N2Si/c1-11(2)8-10(13-6-5-7-15)9-12(3,4)14-11/h10,13-14H,5-9H2,1-4H3
InChIKeyXOBYPROYGOZJPG-UHFFFAOYSA-N
MW225.43 g/mol
LogP1.86
Rot. Bonds4

About CID 22982947

CID 22982947 (PubChem CID 22982947) has the molecular formula C12H25N2Si and a molecular weight of 225.43 g/mol.

Molecular Properties

Compound NameCID 22982947
PubChem CID22982947
Molecular FormulaC12H25N2Si
Molecular Weight225.43 g/mol
Exact Mass225.18
IUPAC Name—
SMILESCC1(C)CC(NCCC[Si])CC(C)(C)N1
InChIInChI=1S/C12H25N2Si/c1-11(2)8-10(13-6-5-7-15)9-12(3,4)14-11/h10,13-14H,5-9H2,1-4H3
InChIKeyXOBYPROYGOZJPG-UHFFFAOYSA-N
XLogP1.86
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.43
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 22982947?
The IUPAC name of CID 22982947 (CID 22982947) is not available.
What is the SMILES notation for CID 22982947?
The canonical SMILES for CID 22982947 is CC1(C)CC(NCCC[Si])CC(C)(C)N1.
What is the InChIKey of CID 22982947?
The InChIKey is XOBYPROYGOZJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N2Si/c1-11(2)8-10(13-6-5-7-15)9-12(3,4)14-11/h10,13-14H,5-9H2,1-4H3.
What are the key properties of CID 22982947?
CID 22982947 has a molecular weight of 225.43 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22982947 is sourced from PubChem (CID 22982947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).