N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine

CH2N12S — CID 74047186

IUPACN-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine
SMILESC=NN=NN=NN=NN=NN=NN=S
InChIInChI=1S/CH2N12S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h1H2
InChIKeyHFQRWFCQPUMSDH-UHFFFAOYSA-N
MW214.18 g/mol
LogP2.17
Rot. Bonds6

About N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine

N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine (PubChem CID 74047186) has the molecular formula CH2N12S and a molecular weight of 214.18 g/mol. Its IUPAC name is N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine.

Molecular Properties

Compound NameN-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine
PubChem CID74047186
Molecular FormulaCH2N12S
Molecular Weight214.18 g/mol
Exact Mass214.02
IUPAC NameN-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine
SMILESC=NN=NN=NN=NN=NN=NN=S
InChIInChI=1S/CH2N12S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h1H2
InChIKeyHFQRWFCQPUMSDH-UHFFFAOYSA-N
XLogP2.17
TPSA148.32 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.18
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine?
The IUPAC name of N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine (CID 74047186) is N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine.
What is the SMILES notation for N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine?
The canonical SMILES for N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine is C=NN=NN=NN=NN=NN=NN=S.
What is the InChIKey of N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine?
The InChIKey is HFQRWFCQPUMSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2N12S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h1H2.
What are the key properties of N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine?
N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine has a molecular weight of 214.18 g/mol, XLogP of 2.17, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[[[(thionitrosodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]methanimine is sourced from PubChem (CID 74047186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).