CID 123352197

C9H17N2Si+ — CID 123352197

IUPAC—
SMILESCCCCCN1C=CC=[N+](C)[Si]1
InChIInChI=1S/C9H17N2Si/c1-3-4-5-8-11-9-6-7-10(2)12-11/h6-7,9H,3-5,8H2,1-2H3/q+1
InChIKeyMIZDHWWOARIOJM-UHFFFAOYSA-N
MW181.34 g/mol
LogP1.25
Rot. Bonds4

About CID 123352197

CID 123352197 (PubChem CID 123352197) has the molecular formula C9H17N2Si+ and a molecular weight of 181.34 g/mol.

Molecular Properties

Compound NameCID 123352197
PubChem CID123352197
Molecular FormulaC9H17N2Si+
Molecular Weight181.34 g/mol
Exact Mass181.12
IUPAC Name—
SMILESCCCCCN1C=CC=[N+](C)[Si]1
InChIInChI=1S/C9H17N2Si/c1-3-4-5-8-11-9-6-7-10(2)12-11/h6-7,9H,3-5,8H2,1-2H3/q+1
InChIKeyMIZDHWWOARIOJM-UHFFFAOYSA-N
XLogP1.25
TPSA6.25 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.34
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 123352197?
The IUPAC name of CID 123352197 (CID 123352197) is not available.
What is the SMILES notation for CID 123352197?
The canonical SMILES for CID 123352197 is CCCCCN1C=CC=[N+](C)[Si]1.
What is the InChIKey of CID 123352197?
The InChIKey is MIZDHWWOARIOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N2Si/c1-3-4-5-8-11-9-6-7-10(2)12-11/h6-7,9H,3-5,8H2,1-2H3/q+1.
What are the key properties of CID 123352197?
CID 123352197 has a molecular weight of 181.34 g/mol, XLogP of 1.25, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 123352197 is sourced from PubChem (CID 123352197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).