N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine

C11H12N4 — CID 12592831

IUPACN,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine
SMILESCN(C)c1nncc(-c2ccccc2)n1
InChIInChI=1S/C11H12N4/c1-15(2)11-13-10(8-12-14-11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKeyAFYMVRMZTWWBRM-UHFFFAOYSA-N
MW200.25 g/mol
LogP1.60
Rot. Bonds2

About N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine

N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine (PubChem CID 12592831) has the molecular formula C11H12N4 and a molecular weight of 200.25 g/mol. Its IUPAC name is N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine
PubChem CID12592831
Molecular FormulaC11H12N4
Molecular Weight200.25 g/mol
Exact Mass200.11
IUPAC NameN,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine
SMILESCN(C)c1nncc(-c2ccccc2)n1
InChIInChI=1S/C11H12N4/c1-15(2)11-13-10(8-12-14-11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKeyAFYMVRMZTWWBRM-UHFFFAOYSA-N
XLogP1.60
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.25
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine
CID 70588
3-(Methylthio)-5-phenyl-1,2,4-triazine
CID 98541
5-(3-(Difluoromethyl)-4-fluorophenyl)-3-((2-methyl-1H-imidazol-1-yl)methyl)pyridazine
CID 22240172
4-phenyl-N~1~-[(1E)-phenylmethylene]-1H-imidazole-1,2-diamine
CID 6858937
5-Phenyl-1,2,4-triazin-3-amine
CID 97081
6-Phenyl-1,2,4-triazin-3-amine
CID 120468
6-(4-Fluorophenyl)-2,3-dimethylimidazo[1,2-b][1,2,4]triazine
CID 618001
6-(4-Ethylphenyl)-2-phenylimidazo[1,2-b][1,2,4]triazine
CID 627189
2,3-Dimethyl-6-phenylimidazo[1,2-b][1,2,4]triazine
CID 614255
2,6-Diphenylimidazo[1,2-b][1,2,4]triazine
CID 623378
1,2,4-Triazine, 5-(4-chlorophenyl)-3-(methylthio)-
CID 2799497
as-Triazine, 5-(p-bromophenyl)-3-(methylthio)-
CID 3053041

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine?
The IUPAC name of N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine (CID 12592831) is N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine.
What is the SMILES notation for N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine?
The canonical SMILES for N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine is CN(C)c1nncc(-c2ccccc2)n1.
What is the InChIKey of N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine?
The InChIKey is AFYMVRMZTWWBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4/c1-15(2)11-13-10(8-12-14-11)9-6-4-3-5-7-9/h3-8H,1-2H3.
What are the key properties of N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine?
N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine has a molecular weight of 200.25 g/mol, XLogP of 1.60, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-phenyl-1,2,4-triazin-3-amine is sourced from PubChem (CID 12592831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).