5-methyl-2-(2-methylphenyl)triazol-4-amine

C10H12N4 — CID 97058283

IUPAC5-methyl-2-(2-methylphenyl)triazol-4-amine
SMILESCc1ccccc1-n1nc(C)c(N)n1
InChIInChI=1S/C10H12N4/c1-7-5-3-4-6-9(7)14-12-8(2)10(11)13-14/h3-6H,1-2H3,(H2,11,13)
InChIKeyHINQRHSYVVAPEX-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.47
Rot. Bonds1

About 5-methyl-2-(2-methylphenyl)triazol-4-amine

5-methyl-2-(2-methylphenyl)triazol-4-amine (PubChem CID 97058283) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 5-methyl-2-(2-methylphenyl)triazol-4-amine.

Molecular Properties

Compound Name5-methyl-2-(2-methylphenyl)triazol-4-amine
PubChem CID97058283
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name5-methyl-2-(2-methylphenyl)triazol-4-amine
SMILESCc1ccccc1-n1nc(C)c(N)n1
InChIInChI=1S/C10H12N4/c1-7-5-3-4-6-9(7)14-12-8(2)10(11)13-14/h3-6H,1-2H3,(H2,11,13)
InChIKeyHINQRHSYVVAPEX-UHFFFAOYSA-N
XLogP1.47
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 5-methyl-2-(2-methylphenyl)triazole-4-carboxylate
CID 50873970
2-(2,6-dichloro-3-pyridinyl)-5-methyltriazol-4-amine
CID 97057734
2-(2-chlorophenyl)-4,5-dimethyltriazole
CID 21395782
4-(aminomethyl)-1-(2-methylphenyl)pyrazole-3,5-diamine
CID 115056348
3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine
CID 83864038
3-amino-1-(2-methylphenyl)pyrazole-4-carbonitrile
CID 79002314
3-cyclohexyl-1-(2-methylphenyl)pyrazol-5-amine
CID 82088784
4-(2-aminoethyl)-1-(2-methylphenyl)pyrazole-3,5-diamine
CID 115056349
2-(2,5-dimethylphenyl)-4,5-dimethyltriazole
CID 54146141
3-bromo-5-methyl-1-(2-methylphenyl)pyrazole
CID 59022551
1-(2-methylphenyl)-3-(3-methylphenyl)pyrazol-5-amine
CID 4598830
3-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide
CID 91675755

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-methylphenyl)triazol-4-amine?
The IUPAC name of 5-methyl-2-(2-methylphenyl)triazol-4-amine (CID 97058283) is 5-methyl-2-(2-methylphenyl)triazol-4-amine.
What is the SMILES notation for 5-methyl-2-(2-methylphenyl)triazol-4-amine?
The canonical SMILES for 5-methyl-2-(2-methylphenyl)triazol-4-amine is Cc1ccccc1-n1nc(C)c(N)n1.
What is the InChIKey of 5-methyl-2-(2-methylphenyl)triazol-4-amine?
The InChIKey is HINQRHSYVVAPEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-7-5-3-4-6-9(7)14-12-8(2)10(11)13-14/h3-6H,1-2H3,(H2,11,13).
What are the key properties of 5-methyl-2-(2-methylphenyl)triazol-4-amine?
5-methyl-2-(2-methylphenyl)triazol-4-amine has a molecular weight of 188.23 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-methylphenyl)triazol-4-amine is sourced from PubChem (CID 97058283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).