CID 67239930

C12H25NO2Si — CID 67239930

IUPAC—
SMILESCCOC(OCC)[Si]CCCN1CCCC1
InChIInChI=1S/C12H25NO2Si/c1-3-14-12(15-4-2)16-11-7-10-13-8-5-6-9-13/h12H,3-11H2,1-2H3
InChIKeyUWDYRLFNNDHDHA-UHFFFAOYSA-N
MW243.42 g/mol
LogP1.95
Rot. Bonds9

About CID 67239930

CID 67239930 (PubChem CID 67239930) has the molecular formula C12H25NO2Si and a molecular weight of 243.42 g/mol.

Molecular Properties

Compound NameCID 67239930
PubChem CID67239930
Molecular FormulaC12H25NO2Si
Molecular Weight243.42 g/mol
Exact Mass243.17
IUPAC Name—
SMILESCCOC(OCC)[Si]CCCN1CCCC1
InChIInChI=1S/C12H25NO2Si/c1-3-14-12(15-4-2)16-11-7-10-13-8-5-6-9-13/h12H,3-11H2,1-2H3
InChIKeyUWDYRLFNNDHDHA-UHFFFAOYSA-N
XLogP1.95
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.42
LogP ≤ 51.95
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': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

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ethane;1-(3-ethoxypropyl)pyrrolidine;methane;propane
CID 156885032
N-ethoxy-3-pyrrolidin-1-ylpropan-1-amine
CID 64974363
1-butylpyrrolidine;diethoxysilane
CID 173014045
CID 178023178
CID 178023178
1-octylazonane
CID 20533821
1-decylpiperidine
CID 4649960
1-dodecylazepane
CID 3366129

Frequently Asked Questions

What is the IUPAC name of CID 67239930?
The IUPAC name of CID 67239930 (CID 67239930) is not available.
What is the SMILES notation for CID 67239930?
The canonical SMILES for CID 67239930 is CCOC(OCC)[Si]CCCN1CCCC1.
What is the InChIKey of CID 67239930?
The InChIKey is UWDYRLFNNDHDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2Si/c1-3-14-12(15-4-2)16-11-7-10-13-8-5-6-9-13/h12H,3-11H2,1-2H3.
What are the key properties of CID 67239930?
CID 67239930 has a molecular weight of 243.42 g/mol, XLogP of 1.95, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67239930 is sourced from PubChem (CID 67239930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).