CID 151884327
N12 — CID 151884327
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC—
SMILES[N-]=[N+]=NN=NN(N=[N+]=[N-])N=[N+]=[N-]
InChIInChI=1S/N12/c1-4-7-8-11-12(9-5-2)10-6-3
InChIKeySPJQUSYZPKXGON-UHFFFAOYSA-N
MW168.08 g/mol
LogP2.33
Rot. Bonds4
About CID 151884327
CID 151884327 (PubChem CID 151884327) has the molecular formula N12 and a molecular weight of 168.08 g/mol.
Molecular Properties
| Compound Name | CID 151884327 |
|---|---|
| PubChem CID | 151884327 |
| Molecular Formula | N12 |
| Molecular Weight | 168.08 g/mol |
| Exact Mass | 168.04 |
| IUPAC Name | — |
| SMILES | [N-]=[N+]=NN=NN(N=[N+]=[N-])N=[N+]=[N-] |
| InChI | InChI=1S/N12/c1-4-7-8-11-12(9-5-2)10-6-3 |
| InChIKey | SPJQUSYZPKXGON-UHFFFAOYSA-N |
| XLogP | 2.33 |
| TPSA | 174.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 168.08 |
| LogP ≤ 5 | 2.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
What is the IUPAC name of CID 151884327?
The IUPAC name of CID 151884327 (CID 151884327) is not available.
What is the SMILES notation for CID 151884327?
The canonical SMILES for CID 151884327 is [N-]=[N+]=NN=NN(N=[N+]=[N-])N=[N+]=[N-].
What is the InChIKey of CID 151884327?
The InChIKey is SPJQUSYZPKXGON-UHFFFAOYSA-N. The full InChI is InChI=1S/N12/c1-4-7-8-11-12(9-5-2)10-6-3.
What are the key properties of CID 151884327?
CID 151884327 has a molecular weight of 168.08 g/mol, XLogP of 2.33, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 151884327 is sourced from PubChem (CID 151884327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.
Sources
- PubChem CID 151884327 — identifiers, structure, computed properties (public domain)
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