N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline

C8H9N7 — CID 137190281

IUPACN-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline
SMILESCN(N=Nc1nn[nH]n1)c1ccccc1
InChIInChI=1S/C8H9N7/c1-15(7-5-3-2-4-6-7)14-11-8-9-12-13-10-8/h2-6H,1H3,(H,9,10,12,13)
InChIKeyPADOUFAUHGNAMG-UHFFFAOYSA-N
MW203.21 g/mol
LogP1.33
Rot. Bonds3

About N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline

N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline (PubChem CID 137190281) has the molecular formula C8H9N7 and a molecular weight of 203.21 g/mol. Its IUPAC name is N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline.

Molecular Properties

Compound NameN-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline
PubChem CID137190281
Molecular FormulaC8H9N7
Molecular Weight203.21 g/mol
Exact Mass203.09
IUPAC NameN-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline
SMILESCN(N=Nc1nn[nH]n1)c1ccccc1
InChIInChI=1S/C8H9N7/c1-15(7-5-3-2-4-6-7)14-11-8-9-12-13-10-8/h2-6H,1H3,(H,9,10,12,13)
InChIKeyPADOUFAUHGNAMG-UHFFFAOYSA-N
XLogP1.33
TPSA82.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.21
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[(E)-2H-tetrazol-5-yldiazenyl]methanol
CID 137267834
N-[(4-chloro-2-methylphenyl)diazenyl]-N-methylaniline
CID 71395427
anthracen-9-ylmethyl(2H-tetrazol-5-yl)diazene
CID 136600638
N-(fluoromethyl)-N-phenyl-2H-tetrazol-5-amine
CID 141001774
N,N-bis[2-(2H-tetrazol-5-yl)ethyl]aniline
CID 21330973
2-methylpropyl-oxo-phenyl-(2H-tetrazol-5-ylimino)-λ6-sulfane
CID 102322315
2-(2H-tetrazol-5-ylimino)indene-1,3-dione
CID 5338641
(4-methoxyphenyl)methyl-(2H-tetrazol-5-yl)diazene
CID 170922069
4-methyl-N-[methyl(phenyl)hydrazinylidene]benzenesulfonamide
CID 71375412
N-ethyl-N-phenyl-2-(2H-tetrazol-5-yl)acetamide
CID 110498051
N-methyl-N-[3-(2H-tetrazol-5-yl)phenyl]naphthalen-1-amine
CID 66965266
N-methyl-N-(3-nitrophenyl)-2H-tetrazol-5-amine
CID 10822772

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline?
The IUPAC name of N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline (CID 137190281) is N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline.
What is the SMILES notation for N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline?
The canonical SMILES for N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline is CN(N=Nc1nn[nH]n1)c1ccccc1.
What is the InChIKey of N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline?
The InChIKey is PADOUFAUHGNAMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N7/c1-15(7-5-3-2-4-6-7)14-11-8-9-12-13-10-8/h2-6H,1H3,(H,9,10,12,13).
What are the key properties of N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline?
N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline has a molecular weight of 203.21 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline is sourced from PubChem (CID 137190281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).