6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine

C10H8Cl2N4 — CID 116823509

IUPAC6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine
SMILESCc1nnc(-c2ccc(Cl)c(Cl)c2)c(N)n1
InChIInChI=1S/C10H8Cl2N4/c1-5-14-10(13)9(16-15-5)6-2-3-7(11)8(12)4-6/h2-4H,1H3,(H2,13,14,15)
InChIKeyUFGKVPDAJGCBHW-UHFFFAOYSA-N
MW255.11 g/mol
LogP2.74
Rot. Bonds1

About 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine

6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine (PubChem CID 116823509) has the molecular formula C10H8Cl2N4 and a molecular weight of 255.11 g/mol. Its IUPAC name is 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine.

Molecular Properties

Compound Name6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine
PubChem CID116823509
Molecular FormulaC10H8Cl2N4
Molecular Weight255.11 g/mol
Exact Mass254.01
IUPAC Name6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine
SMILESCc1nnc(-c2ccc(Cl)c(Cl)c2)c(N)n1
InChIInChI=1S/C10H8Cl2N4/c1-5-14-10(13)9(16-15-5)6-2-3-7(11)8(12)4-6/h2-4H,1H3,(H2,13,14,15)
InChIKeyUFGKVPDAJGCBHW-UHFFFAOYSA-N
XLogP2.74
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.11
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-6-(3-methylphenyl)-1,2,4-triazin-5-amine
CID 116823512
6-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-1,2,4-triazin-5-amine
CID 116823432
2-cyclopropyl-6-(3,4-dichlorophenyl)-5-methylpyrimidin-4-amine
CID 80975439
3-(3,4-dichlorophenyl)-5-methylaniline
CID 107579512
4-(3,4-dichlorophenyl)-1,2,5-oxadiazol-3-amine
CID 62501533
3-methyl-6-(2,4,5-trimethylphenyl)-1,2,4-triazin-5-amine
CID 116823472
5-bromo-4-(3,4-dichlorophenyl)-1-methylimidazol-2-amine
CID 84604378
5-(3,4-dichlorophenyl)-6-methylpyrimidin-4-amine
CID 82298713
6-[3-(4-chlorophenyl)phenyl]-1,2,4-triazine-3,5-diamine
CID 121410399
4-(3,4-dichlorophenyl)-5-(4-methylphenyl)-1H-pyrazol-3-amine
CID 63525572
2-(3,4-dichlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 56687055
6-(2-methoxy-5-propan-2-ylphenyl)-3-methyl-1,2,4-triazin-5-amine
CID 116823436

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine?
The IUPAC name of 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine (CID 116823509) is 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine.
What is the SMILES notation for 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine?
The canonical SMILES for 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine is Cc1nnc(-c2ccc(Cl)c(Cl)c2)c(N)n1.
What is the InChIKey of 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine?
The InChIKey is UFGKVPDAJGCBHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N4/c1-5-14-10(13)9(16-15-5)6-2-3-7(11)8(12)4-6/h2-4H,1H3,(H2,13,14,15).
What are the key properties of 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine?
6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine has a molecular weight of 255.11 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dichlorophenyl)-3-methyl-1,2,4-triazin-5-amine is sourced from PubChem (CID 116823509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).