1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine

C11H13N5 — CID 3053953

IUPAC1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine
SMILESCNNc1nncc(-c2ccc(C)cc2)n1
InChIInChI=1S/C11H13N5/c1-8-3-5-9(6-4-8)10-7-13-16-11(14-10)15-12-2/h3-7,12H,1-2H3,(H,14,15,16)
InChIKeyJVRLQKAEXKGVIA-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.39
Rot. Bonds3

About 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine

1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine (PubChem CID 3053953) has the molecular formula C11H13N5 and a molecular weight of 215.26 g/mol. Its IUPAC name is 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine.

Molecular Properties

Compound Name1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine
PubChem CID3053953
Molecular FormulaC11H13N5
Molecular Weight215.26 g/mol
Exact Mass215.12
IUPAC Name1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine
SMILESCNNc1nncc(-c2ccc(C)cc2)n1
InChIInChI=1S/C11H13N5/c1-8-3-5-9(6-4-8)10-7-13-16-11(14-10)15-12-2/h3-7,12H,1-2H3,(H,14,15,16)
InChIKeyJVRLQKAEXKGVIA-UHFFFAOYSA-N
XLogP1.39
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-(Methylthio)-5-phenyl-1,2,4-triazine
CID 98541
5-Phenyl-1,2,4-triazin-3-amine
CID 97081
6-Phenyl-1,2,4-triazin-3-amine
CID 120468
3-Hydrazino-5,6-diphenyl-1,2,4-triazine
CID 601464
5-(4-Bromophenyl)-1,2,4-triazin-3-amine
CID 7176091
7-Phenyltetrazolo[1,5-b][1,2,4]triazine
CID 319734
2,3-Dimethyl-6-(4-methylphenyl)imidazo[1,2-b][1,2,4]triazine
CID 617210
5-Phenyl-3-(piperidin-1-yl)-1,2,4-triazine
CID 6400923
Acetic acid, trifluoro-, 2-(5-phenyl-3-as-triazinyl)hydrazide
CID 50569
Acetic acid, 2-(5-phenyl-3-as-triazinyl)hydrazide
CID 50570
as-Triazine, 3-hydrazino-5-phenyl-
CID 98542
as-Triazine, 5-(4-chlorophenyl)-3-hydrazino-
CID 3042263

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine?
The IUPAC name of 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine (CID 3053953) is 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine.
What is the SMILES notation for 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine?
The canonical SMILES for 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine is CNNc1nncc(-c2ccc(C)cc2)n1.
What is the InChIKey of 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine?
The InChIKey is JVRLQKAEXKGVIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5/c1-8-3-5-9(6-4-8)10-7-13-16-11(14-10)15-12-2/h3-7,12H,1-2H3,(H,14,15,16).
What are the key properties of 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine?
1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine has a molecular weight of 215.26 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]hydrazine is sourced from PubChem (CID 3053953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).