CID 137158045

C5H12N3Si — CID 137158045

IUPAC—
SMILESC[Si](C)CCCN=[N+]=[N-]
InChIInChI=1S/C5H12N3Si/c1-9(2)5-3-4-7-8-6/h3-5H2,1-2H3
InChIKeyKHWSODHLZRZFPV-UHFFFAOYSA-N
MW142.26 g/mol
LogP2.44
Rot. Bonds4

About CID 137158045

CID 137158045 (PubChem CID 137158045) has the molecular formula C5H12N3Si and a molecular weight of 142.26 g/mol.

Molecular Properties

Compound NameCID 137158045
PubChem CID137158045
Molecular FormulaC5H12N3Si
Molecular Weight142.26 g/mol
Exact Mass142.08
IUPAC Name—
SMILESC[Si](C)CCCN=[N+]=[N-]
InChIInChI=1S/C5H12N3Si/c1-9(2)5-3-4-7-8-6/h3-5H2,1-2H3
InChIKeyKHWSODHLZRZFPV-UHFFFAOYSA-N
XLogP2.44
TPSA48.76 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.26
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze CID 137158045 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 137158045?
The IUPAC name of CID 137158045 (CID 137158045) is not available.
What is the SMILES notation for CID 137158045?
The canonical SMILES for CID 137158045 is C[Si](C)CCCN=[N+]=[N-].
What is the InChIKey of CID 137158045?
The InChIKey is KHWSODHLZRZFPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N3Si/c1-9(2)5-3-4-7-8-6/h3-5H2,1-2H3.
What are the key properties of CID 137158045?
CID 137158045 has a molecular weight of 142.26 g/mol, XLogP of 2.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 137158045 is sourced from PubChem (CID 137158045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).