CID 140676853

C13H25N2Si+ — CID 140676853

IUPAC—
SMILESCCCCN1[Si][N+](CCCC)=C(C)C=C1C
InChIInChI=1S/C13H25N2Si/c1-5-7-9-14-12(3)11-13(4)15(16-14)10-8-6-2/h11H,5-10H2,1-4H3/q+1
InChIKeyRXTAOUANPWXELR-UHFFFAOYSA-N
MW237.44 g/mol
LogP2.81
Rot. Bonds6

About CID 140676853

CID 140676853 (PubChem CID 140676853) has the molecular formula C13H25N2Si+ and a molecular weight of 237.44 g/mol.

Molecular Properties

Compound NameCID 140676853
PubChem CID140676853
Molecular FormulaC13H25N2Si+
Molecular Weight237.44 g/mol
Exact Mass237.18
IUPAC Name—
SMILESCCCCN1[Si][N+](CCCC)=C(C)C=C1C
InChIInChI=1S/C13H25N2Si/c1-5-7-9-14-12(3)11-13(4)15(16-14)10-8-6-2/h11H,5-10H2,1-4H3/q+1
InChIKeyRXTAOUANPWXELR-UHFFFAOYSA-N
XLogP2.81
TPSA6.25 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.44
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 140676853?
The IUPAC name of CID 140676853 (CID 140676853) is not available.
What is the SMILES notation for CID 140676853?
The canonical SMILES for CID 140676853 is CCCCN1[Si][N+](CCCC)=C(C)C=C1C.
What is the InChIKey of CID 140676853?
The InChIKey is RXTAOUANPWXELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N2Si/c1-5-7-9-14-12(3)11-13(4)15(16-14)10-8-6-2/h11H,5-10H2,1-4H3/q+1.
What are the key properties of CID 140676853?
CID 140676853 has a molecular weight of 237.44 g/mol, XLogP of 2.81, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 140676853 is sourced from PubChem (CID 140676853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).