CID 87974631

C8H20NOSi — CID 87974631

IUPAC—
SMILESCCCC[Si](CCCN)OC
InChIInChI=1S/C8H20NOSi/c1-3-4-7-11(10-2)8-5-6-9/h3-9H2,1-2H3
InChIKeySEHSKUCIWZNQRC-UHFFFAOYSA-N
MW174.34 g/mol
LogP1.77
Rot. Bonds7

About CID 87974631

CID 87974631 (PubChem CID 87974631) has the molecular formula C8H20NOSi and a molecular weight of 174.34 g/mol.

Molecular Properties

Compound NameCID 87974631
PubChem CID87974631
Molecular FormulaC8H20NOSi
Molecular Weight174.34 g/mol
Exact Mass174.13
IUPAC Name—
SMILESCCCC[Si](CCCN)OC
InChIInChI=1S/C8H20NOSi/c1-3-4-7-11(10-2)8-5-6-9/h3-9H2,1-2H3
InChIKeySEHSKUCIWZNQRC-UHFFFAOYSA-N
XLogP1.77
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.34
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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CID 87823121
2-[(Aminomethyl)(methoxy)silyl]ethan-1-amine
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tetrakis(butan-1-amine);tetraiodoplumbane
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CID 161377074
butane-1,4-diamine;hexan-1-amine
CID 162097736
tridecan-1-amine;undecan-1-amine
CID 23045943
decan-1-amine;hexan-1-amine
CID 162216125
hexacosan-1-amine
CID 14550481
dotetracontan-1-amine
CID 14550497
3-[4-(2-butoxyethoxy)butoxy]propan-1-amine
CID 118457159

Frequently Asked Questions

What is the IUPAC name of CID 87974631?
The IUPAC name of CID 87974631 (CID 87974631) is not available.
What is the SMILES notation for CID 87974631?
The canonical SMILES for CID 87974631 is CCCC[Si](CCCN)OC.
What is the InChIKey of CID 87974631?
The InChIKey is SEHSKUCIWZNQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20NOSi/c1-3-4-7-11(10-2)8-5-6-9/h3-9H2,1-2H3.
What are the key properties of CID 87974631?
CID 87974631 has a molecular weight of 174.34 g/mol, XLogP of 1.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87974631 is sourced from PubChem (CID 87974631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).