CID 22982953

C14H30NOSi — CID 22982953

IUPAC
SMILESC[Si](C)CCCOC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H30NOSi/c1-13(2)10-12(11-14(3,4)15-13)16-8-7-9-17(5)6/h12,15H,7-11H2,1-6H3
InChIKeySHXUZCGXYFELAJ-UHFFFAOYSA-N
MW256.49 g/mol
LogP3.46
Rot. Bonds5

About CID 22982953

CID 22982953 (PubChem CID 22982953) has the molecular formula C14H30NOSi and a molecular weight of 256.49 g/mol.

Molecular Properties

Compound NameCID 22982953
PubChem CID22982953
Molecular FormulaC14H30NOSi
Molecular Weight256.49 g/mol
Exact Mass256.21
IUPAC Name
SMILESC[Si](C)CCCOC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H30NOSi/c1-13(2)10-12(11-14(3,4)15-13)16-8-7-9-17(5)6/h12,15H,7-11H2,1-6H3
InChIKeySHXUZCGXYFELAJ-UHFFFAOYSA-N
XLogP3.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.49
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 22982953?
The IUPAC name of CID 22982953 (CID 22982953) is not available.
What is the SMILES notation for CID 22982953?
The canonical SMILES for CID 22982953 is C[Si](C)CCCOC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of CID 22982953?
The InChIKey is SHXUZCGXYFELAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30NOSi/c1-13(2)10-12(11-14(3,4)15-13)16-8-7-9-17(5)6/h12,15H,7-11H2,1-6H3.
What are the key properties of CID 22982953?
CID 22982953 has a molecular weight of 256.49 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22982953 is sourced from PubChem (CID 22982953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).