1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine

C27H24N10+2 — CID 10769443

IUPAC1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine
SMILESCN(Nc1nn(-c2ccccc2)n[n+]1-c1ccccc1)c1nn(-c2ccccc2)n[n+]1-c1ccccc1
InChIInChI=1S/C27H24N10/c1-33(27-30-37(25-20-12-5-13-21-25)32-35(27)23-16-8-3-9-17-23)28-26-29-36(24-18-10-4-11-19-24)31-34(26)22-14-6-2-7-15-22/h2-21H,1H3,(H,28,29,31)/q+2
InChIKeyLNZMKXCNEUOQDO-UHFFFAOYSA-N
MW488.56 g/mol
LogP2.86
Rot. Bonds7

About 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine

1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine (PubChem CID 10769443) has the molecular formula C27H24N10+2 and a molecular weight of 488.56 g/mol. Its IUPAC name is 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine.

Molecular Properties

Compound Name1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine
PubChem CID10769443
Molecular FormulaC27H24N10+2
Molecular Weight488.56 g/mol
Exact Mass488.22
IUPAC Name1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine
SMILESCN(Nc1nn(-c2ccccc2)n[n+]1-c1ccccc1)c1nn(-c2ccccc2)n[n+]1-c1ccccc1
InChIInChI=1S/C27H24N10/c1-33(27-30-37(25-20-12-5-13-21-25)32-35(27)23-16-8-3-9-17-23)28-26-29-36(24-18-10-4-11-19-24)31-34(26)22-14-6-2-7-15-22/h2-21H,1H3,(H,28,29,31)/q+2
InChIKeyLNZMKXCNEUOQDO-UHFFFAOYSA-N
XLogP2.86
TPSA84.45 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.56
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine with MolForge

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

Launch Full Analysis

Related Compounds

5-chloro-1,3-diphenyltetrazol-1-ium tetrafluoroborate
CID 11013369
1,3-diphenyl-5-pyrrolidin-1-yltetrazol-1-ium
CID 10499916
(1,3-diphenyltetrazol-1-ium-5-yl)imino-triphenyl-λ5-phosphane
CID 11801450
N'-anilino-1,3-diphenyl-N-phenyliminotetrazol-1-ium-5-carboximidamide
CID 74031936
3-phenyl-1-(2,4,6-trimethylphenyl)tetrazol-1-ium-5-olate
CID 10731440
(Z)-2-[[(E)-N-(1,3-diphenyltetrazol-1-ium-5-yl)-C-methoxycarbonylcarbonimidoyl]diazenyl]-1-methoxyethenolate
CID 10993203
8,13,15-trimethyl-4-phenyl-3,4,5,7,9-pentaza-2-azoniatricyclo[9.4.0.02,6]pentadeca-1(15),2,5,8,11,13-hexaene
CID 135611816
2-N,2-N,2-trimethyl-1-N-[(2-phenyltriazol-4-yl)methyl]propane-1,2-diamine
CID 28774650
4-methyl-5-methylsulfanyl-2-phenyltriazole
CID 12815844
ethane;methanol;bis(2-phenylbenzotriazole)
CID 162119776
N-[(E)-(1,3-diphenyl-1,2-diaza-3-azonia-4-azanidacyclopent-2-en-5-ylidene)amino]-N-methylaniline
CID 10545250
N,N-dimethyl-2-phenyltriazole-4-carboxamide
CID 22103711

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine?
The IUPAC name of 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine (CID 10769443) is 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine.
What is the SMILES notation for 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine?
The canonical SMILES for 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine is CN(Nc1nn(-c2ccccc2)n[n+]1-c1ccccc1)c1nn(-c2ccccc2)n[n+]1-c1ccccc1.
What is the InChIKey of 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine?
The InChIKey is LNZMKXCNEUOQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N10/c1-33(27-30-37(25-20-12-5-13-21-25)32-35(27)23-16-8-3-9-17-23)28-26-29-36(24-18-10-4-11-19-24)31-34(26)22-14-6-2-7-15-22/h2-21H,1H3,(H,28,29,31)/q+2.
What are the key properties of 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine?
1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine has a molecular weight of 488.56 g/mol, XLogP of 2.86, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(1,3-diphenyltetrazol-1-ium-5-yl)-1-methylhydrazine is sourced from PubChem (CID 10769443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).