CID 59800207

C5H11NOSi — CID 59800207

IUPAC—
SMILESC[Si]N1CC[C@H](O)C1
InChIInChI=1S/C5H11NOSi/c1-8-6-3-2-5(7)4-6/h5,7H,2-4H2,1H3/t5-/m0/s1
InChIKeyMTBNVGJDIONBMQ-YFKPBYRVSA-N
MW129.23 g/mol
LogP-0.28
Rot. Bonds1

About CID 59800207

CID 59800207 (PubChem CID 59800207) has the molecular formula C5H11NOSi and a molecular weight of 129.23 g/mol.

Molecular Properties

Compound NameCID 59800207
PubChem CID59800207
Molecular FormulaC5H11NOSi
Molecular Weight129.23 g/mol
Exact Mass129.06
IUPAC Name—
SMILESC[Si]N1CC[C@H](O)C1
InChIInChI=1S/C5H11NOSi/c1-8-6-3-2-5(7)4-6/h5,7H,2-4H2,1H3/t5-/m0/s1
InChIKeyMTBNVGJDIONBMQ-YFKPBYRVSA-N
XLogP-0.28
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.23
LogP ≤ 5-0.28
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 59800207?
The IUPAC name of CID 59800207 (CID 59800207) is not available.
What is the SMILES notation for CID 59800207?
The canonical SMILES for CID 59800207 is C[Si]N1CC[C@H](O)C1.
What is the InChIKey of CID 59800207?
The InChIKey is MTBNVGJDIONBMQ-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H11NOSi/c1-8-6-3-2-5(7)4-6/h5,7H,2-4H2,1H3/t5-/m0/s1.
What are the key properties of CID 59800207?
CID 59800207 has a molecular weight of 129.23 g/mol, XLogP of -0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59800207 is sourced from PubChem (CID 59800207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).