CID 164936142

C7H16N2OSb — CID 164936142

IUPAC—
SMILESCOCCN[Sb]N1CCCC1
InChIInChI=1S/C4H8N.C3H8NO.Sb/c1-2-4-5-3-1;1-5-3-2-4;/h1-4H2;4H,2-3H2,1H3;/q2*-1;+2
InChIKeyNIOAENCSAOQUHT-UHFFFAOYSA-N
MW265.98 g/mol
LogP-0.15
Rot. Bonds5

About CID 164936142

CID 164936142 (PubChem CID 164936142) has the molecular formula C7H16N2OSb and a molecular weight of 265.98 g/mol.

Molecular Properties

Compound NameCID 164936142
PubChem CID164936142
Molecular FormulaC7H16N2OSb
Molecular Weight265.98 g/mol
Exact Mass265.03
IUPAC Name—
SMILESCOCCN[Sb]N1CCCC1
InChIInChI=1S/C4H8N.C3H8NO.Sb/c1-2-4-5-3-1;1-5-3-2-4;/h1-4H2;4H,2-3H2,1H3;/q2*-1;+2
InChIKeyNIOAENCSAOQUHT-UHFFFAOYSA-N
XLogP-0.15
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.98
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 164936142?
The IUPAC name of CID 164936142 (CID 164936142) is not available.
What is the SMILES notation for CID 164936142?
The canonical SMILES for CID 164936142 is COCCN[Sb]N1CCCC1.
What is the InChIKey of CID 164936142?
The InChIKey is NIOAENCSAOQUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N.C3H8NO.Sb/c1-2-4-5-3-1;1-5-3-2-4;/h1-4H2;4H,2-3H2,1H3;/q2*-1;+2.
What are the key properties of CID 164936142?
CID 164936142 has a molecular weight of 265.98 g/mol, XLogP of -0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 164936142 is sourced from PubChem (CID 164936142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).