CID 136805967

C15H23N2Si — CID 136805967

IUPAC—
SMILESCC(C)N1C=CN(C(C)C)[Si](c2ccccc2)C1
InChIInChI=1S/C15H23N2Si/c1-13(2)16-10-11-17(14(3)4)18(12-16)15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3
InChIKeyMPNFOLWPPNMWSQ-UHFFFAOYSA-N
MW259.45 g/mol
LogP2.33
Rot. Bonds3

About CID 136805967

CID 136805967 (PubChem CID 136805967) has the molecular formula C15H23N2Si and a molecular weight of 259.45 g/mol.

Molecular Properties

Compound NameCID 136805967
PubChem CID136805967
Molecular FormulaC15H23N2Si
Molecular Weight259.45 g/mol
Exact Mass259.16
IUPAC Name—
SMILESCC(C)N1C=CN(C(C)C)[Si](c2ccccc2)C1
InChIInChI=1S/C15H23N2Si/c1-13(2)16-10-11-17(14(3)4)18(12-16)15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3
InChIKeyMPNFOLWPPNMWSQ-UHFFFAOYSA-N
XLogP2.33
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.45
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 136805967?
The IUPAC name of CID 136805967 (CID 136805967) is not available.
What is the SMILES notation for CID 136805967?
The canonical SMILES for CID 136805967 is CC(C)N1C=CN(C(C)C)[Si](c2ccccc2)C1.
What is the InChIKey of CID 136805967?
The InChIKey is MPNFOLWPPNMWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N2Si/c1-13(2)16-10-11-17(14(3)4)18(12-16)15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3.
What are the key properties of CID 136805967?
CID 136805967 has a molecular weight of 259.45 g/mol, XLogP of 2.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136805967 is sourced from PubChem (CID 136805967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).