CID 177427837

C16H31NSbSi2 — CID 177427837

IUPAC
SMILESCN(C)Cc1ccccc1[Sb]C([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C9H12N.C7H19Si2.Sb/c1-10(2)8-9-6-4-3-5-7-9;1-8(2,3)7-9(4,5)6;/h3-6H,8H2,1-2H3;7H,1-6H3;
InChIKeyLSKWCQFMOABZRT-UHFFFAOYSA-N
MW415.36 g/mol
LogP3.62
Rot. Bonds6

About CID 177427837

CID 177427837 (PubChem CID 177427837) has the molecular formula C16H31NSbSi2 and a molecular weight of 415.36 g/mol.

Molecular Properties

Compound NameCID 177427837
PubChem CID177427837
Molecular FormulaC16H31NSbSi2
Molecular Weight415.36 g/mol
Exact Mass414.10
IUPAC Name
SMILESCN(C)Cc1ccccc1[Sb]C([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C9H12N.C7H19Si2.Sb/c1-10(2)8-9-6-4-3-5-7-9;1-8(2,3)7-9(4,5)6;/h3-6H,8H2,1-2H3;7H,1-6H3;
InChIKeyLSKWCQFMOABZRT-UHFFFAOYSA-N
XLogP3.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.36
LogP ≤ 53.62
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 177427837?
The IUPAC name of CID 177427837 (CID 177427837) is not available.
What is the SMILES notation for CID 177427837?
The canonical SMILES for CID 177427837 is CN(C)Cc1ccccc1[Sb]C([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of CID 177427837?
The InChIKey is LSKWCQFMOABZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N.C7H19Si2.Sb/c1-10(2)8-9-6-4-3-5-7-9;1-8(2,3)7-9(4,5)6;/h3-6H,8H2,1-2H3;7H,1-6H3;.
What are the key properties of CID 177427837?
CID 177427837 has a molecular weight of 415.36 g/mol, XLogP of 3.62, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 177427837 is sourced from PubChem (CID 177427837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).