CID 59602735

C13H25N2O3Si2 — CID 59602735

IUPAC—
SMILESCC[Si](CCCN1CC(=O)N(CCC[Si]C)C1=O)OC
InChIInChI=1S/C13H25N2O3Si2/c1-4-20(18-2)10-6-7-14-11-12(16)15(13(14)17)8-5-9-19-3/h4-11H2,1-3H3
InChIKeyKAMPUFBQVMFQAM-UHFFFAOYSA-N
MW313.53 g/mol
LogP1.86
Rot. Bonds10

About CID 59602735

CID 59602735 (PubChem CID 59602735) has the molecular formula C13H25N2O3Si2 and a molecular weight of 313.53 g/mol.

Molecular Properties

Compound NameCID 59602735
PubChem CID59602735
Molecular FormulaC13H25N2O3Si2
Molecular Weight313.53 g/mol
Exact Mass313.14
IUPAC Name—
SMILESCC[Si](CCCN1CC(=O)N(CCC[Si]C)C1=O)OC
InChIInChI=1S/C13H25N2O3Si2/c1-4-20(18-2)10-6-7-14-11-12(16)15(13(14)17)8-5-9-19-3/h4-11H2,1-3H3
InChIKeyKAMPUFBQVMFQAM-UHFFFAOYSA-N
XLogP1.86
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.53
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 59602735?
The IUPAC name of CID 59602735 (CID 59602735) is not available.
What is the SMILES notation for CID 59602735?
The canonical SMILES for CID 59602735 is CC[Si](CCCN1CC(=O)N(CCC[Si]C)C1=O)OC.
What is the InChIKey of CID 59602735?
The InChIKey is KAMPUFBQVMFQAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N2O3Si2/c1-4-20(18-2)10-6-7-14-11-12(16)15(13(14)17)8-5-9-19-3/h4-11H2,1-3H3.
What are the key properties of CID 59602735?
CID 59602735 has a molecular weight of 313.53 g/mol, XLogP of 1.86, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59602735 is sourced from PubChem (CID 59602735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).