benzo[c][1,6]benzodiazocine

C14H10N2 — CID 609910

IUPACbenzo[c][1,6]benzodiazocine
SMILESC1=N\c2ccccc2/N=C\c2ccccc2/1
InChIInChI=1S/C14H10N2/c1-2-6-12-10-16-14-8-4-3-7-13(14)15-9-11(12)5-1/h1-10H/b11-9-,12-10-,15-9-,15-13-,16-10-,16-14-
InChIKeyUKJVZYJYAQXAMT-LMTXGQSFSA-N
MW206.25 g/mol
LogP3.50
Rot. Bonds

About benzo[c][1,6]benzodiazocine

benzo[c][1,6]benzodiazocine (PubChem CID 609910) has the molecular formula C14H10N2 and a molecular weight of 206.25 g/mol. Its IUPAC name is benzo[c][1,6]benzodiazocine.

Molecular Properties

Compound Namebenzo[c][1,6]benzodiazocine
PubChem CID609910
Molecular FormulaC14H10N2
Molecular Weight206.25 g/mol
Exact Mass206.08
IUPAC Namebenzo[c][1,6]benzodiazocine
SMILESC1=N\c2ccccc2/N=C\c2ccccc2/1
InChIInChI=1S/C14H10N2/c1-2-6-12-10-16-14-8-4-3-7-13(14)15-9-11(12)5-1/h1-10H/b11-9-,12-10-,15-9-,15-13-,16-10-,16-14-
InChIKeyUKJVZYJYAQXAMT-LMTXGQSFSA-N
XLogP3.50
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze benzo[c][1,6]benzodiazocine 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 benzo[c][1,6]benzodiazocine?
The IUPAC name of benzo[c][1,6]benzodiazocine (CID 609910) is benzo[c][1,6]benzodiazocine.
What is the SMILES notation for benzo[c][1,6]benzodiazocine?
The canonical SMILES for benzo[c][1,6]benzodiazocine is C1=N\c2ccccc2/N=C\c2ccccc2/1.
What is the InChIKey of benzo[c][1,6]benzodiazocine?
The InChIKey is UKJVZYJYAQXAMT-LMTXGQSFSA-N. The full InChI is InChI=1S/C14H10N2/c1-2-6-12-10-16-14-8-4-3-7-13(14)15-9-11(12)5-1/h1-10H/b11-9-,12-10-,15-9-,15-13-,16-10-,16-14-.
What are the key properties of benzo[c][1,6]benzodiazocine?
benzo[c][1,6]benzodiazocine has a molecular weight of 206.25 g/mol, XLogP of 3.50, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[c][1,6]benzodiazocine is sourced from PubChem (CID 609910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).