CID 156776829

C16H26NOSi — CID 156776829

IUPAC—
SMILESCC(C)(C)[Si](Cc1ccccc1)OC[C@H]1CCCN1
InChIInChI=1S/C16H26NOSi/c1-16(2,3)19(13-14-8-5-4-6-9-14)18-12-15-10-7-11-17-15/h4-6,8-9,15,17H,7,10-13H2,1-3H3/t15-/m1/s1
InChIKeyLMOHQWQWJUJQQD-OAHLLOKOSA-N
MW276.48 g/mol
LogP3.33
Rot. Bonds5

About CID 156776829

CID 156776829 (PubChem CID 156776829) has the molecular formula C16H26NOSi and a molecular weight of 276.48 g/mol.

Molecular Properties

Compound NameCID 156776829
PubChem CID156776829
Molecular FormulaC16H26NOSi
Molecular Weight276.48 g/mol
Exact Mass276.18
IUPAC Name—
SMILESCC(C)(C)[Si](Cc1ccccc1)OC[C@H]1CCCN1
InChIInChI=1S/C16H26NOSi/c1-16(2,3)19(13-14-8-5-4-6-9-14)18-12-15-10-7-11-17-15/h4-6,8-9,15,17H,7,10-13H2,1-3H3/t15-/m1/s1
InChIKeyLMOHQWQWJUJQQD-OAHLLOKOSA-N
XLogP3.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.48
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 156776829?
The IUPAC name of CID 156776829 (CID 156776829) is not available.
What is the SMILES notation for CID 156776829?
The canonical SMILES for CID 156776829 is CC(C)(C)[Si](Cc1ccccc1)OC[C@H]1CCCN1.
What is the InChIKey of CID 156776829?
The InChIKey is LMOHQWQWJUJQQD-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H26NOSi/c1-16(2,3)19(13-14-8-5-4-6-9-14)18-12-15-10-7-11-17-15/h4-6,8-9,15,17H,7,10-13H2,1-3H3/t15-/m1/s1.
What are the key properties of CID 156776829?
CID 156776829 has a molecular weight of 276.48 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 156776829 is sourced from PubChem (CID 156776829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).