CID 149072943

C15H25NOSi- — CID 149072943

IUPAC
SMILESCC(=O)N(C)c1cccc([Si-](C)(C)CC(C)C)c1
InChIInChI=1S/C15H25NOSi/c1-12(2)11-18(5,6)15-9-7-8-14(10-15)16(4)13(3)17/h7-10,12H,11H2,1-6H3/q-1
InChIKeyKYXZLUFBIPFOQD-UHFFFAOYSA-N
MW263.46 g/mol
LogP3.24
Rot. Bonds4

About CID 149072943

CID 149072943 (PubChem CID 149072943) has the molecular formula C15H25NOSi- and a molecular weight of 263.46 g/mol.

Molecular Properties

Compound NameCID 149072943
PubChem CID149072943
Molecular FormulaC15H25NOSi-
Molecular Weight263.46 g/mol
Exact Mass263.17
IUPAC Name
SMILESCC(=O)N(C)c1cccc([Si-](C)(C)CC(C)C)c1
InChIInChI=1S/C15H25NOSi/c1-12(2)11-18(5,6)15-9-7-8-14(10-15)16(4)13(3)17/h7-10,12H,11H2,1-6H3/q-1
InChIKeyKYXZLUFBIPFOQD-UHFFFAOYSA-N
XLogP3.24
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.46
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 149072943?
The IUPAC name of CID 149072943 (CID 149072943) is not available.
What is the SMILES notation for CID 149072943?
The canonical SMILES for CID 149072943 is CC(=O)N(C)c1cccc([Si-](C)(C)CC(C)C)c1.
What is the InChIKey of CID 149072943?
The InChIKey is KYXZLUFBIPFOQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NOSi/c1-12(2)11-18(5,6)15-9-7-8-14(10-15)16(4)13(3)17/h7-10,12H,11H2,1-6H3/q-1.
What are the key properties of CID 149072943?
CID 149072943 has a molecular weight of 263.46 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 149072943 is sourced from PubChem (CID 149072943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).