CID 142215030

C3H6B2 — CID 142215030

IUPAC—
SMILES[B]C([B])(C)C
InChIInChI=1S/C3H6B2/c1-3(2,4)5/h1-2H3
InChIKeyDLRPBRWQMRCALN-UHFFFAOYSA-N
MW63.70 g/mol
LogP0.48
Rot. Bonds

About CID 142215030

CID 142215030 (PubChem CID 142215030) has the molecular formula C3H6B2 and a molecular weight of 63.70 g/mol.

Molecular Properties

Compound NameCID 142215030
PubChem CID142215030
Molecular FormulaC3H6B2
Molecular Weight63.70 g/mol
Exact Mass64.07
IUPAC Name—
SMILES[B]C([B])(C)C
InChIInChI=1S/C3H6B2/c1-3(2,4)5/h1-2H3
InChIKeyDLRPBRWQMRCALN-UHFFFAOYSA-N
XLogP0.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50063.70
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 142215030 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 142215030?
The IUPAC name of CID 142215030 (CID 142215030) is not available.
What is the SMILES notation for CID 142215030?
The canonical SMILES for CID 142215030 is [B]C([B])(C)C.
What is the InChIKey of CID 142215030?
The InChIKey is DLRPBRWQMRCALN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6B2/c1-3(2,4)5/h1-2H3.
What are the key properties of CID 142215030?
CID 142215030 has a molecular weight of 63.70 g/mol, XLogP of 0.48, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 142215030 is sourced from PubChem (CID 142215030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).