2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole

C51H64N24 — CID 158191016

IUPAC2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole
SMILESCc1ccccn1.Cc1cccnc1.Cc1cccnn1.Cc1ccnnc1.Cc1cnccn1.Cc1cncnc1.Cc1cncnn1.Cc1ncccn1.Cc1nccnn1.Cn1cncn1.Cn1cnnc1
InChIInChI=1S/2C6H7N.5C5H6N2.2C4H5N3.2C3H5N3/c1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-5-2-6-4-7-3-5;1-5-4-6-2-3-7-5;1-5-2-3-6-7-4-5;1-5-6-3-2-4-7-5;1-5-3-2-4-6-7-5;1-4-2-5-3-6-7-4;1-4-5-2-3-6-7-4;1-6-2-4-5-3-6;1-6-3-4-2-5-6/h2*2-5H,1H3;5*2-4H,1H3;2*2-3H,1H3;2*2-3H,1H3
InChIKeyFZTDTBVJPGBXPN-UHFFFAOYSA-N
MW1013.24 g/mol
LogP6.70
Rot. Bonds

About 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole

2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole (PubChem CID 158191016) has the molecular formula C51H64N24 and a molecular weight of 1013.24 g/mol. Its IUPAC name is 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole.

Molecular Properties

Compound Name2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole
PubChem CID158191016
Molecular FormulaC51H64N24
Molecular Weight1013.24 g/mol
Exact Mass1012.57
IUPAC Name2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole
SMILESCc1ccccn1.Cc1cccnc1.Cc1cccnn1.Cc1ccnnc1.Cc1cnccn1.Cc1cncnc1.Cc1cncnn1.Cc1ncccn1.Cc1nccnn1.Cn1cncn1.Cn1cnnc1
InChIInChI=1S/2C6H7N.5C5H6N2.2C4H5N3.2C3H5N3/c1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-5-2-6-4-7-3-5;1-5-4-6-2-3-7-5;1-5-2-3-6-7-4-5;1-5-6-3-2-4-7-5;1-5-3-2-4-6-7-5;1-4-2-5-3-6-7-4;1-4-5-2-3-6-7-4;1-6-2-4-5-3-6;1-6-3-4-2-5-6/h2*2-5H,1H3;5*2-4H,1H3;2*2-3H,1H3;2*2-3H,1H3
InChIKeyFZTDTBVJPGBXPN-UHFFFAOYSA-N
XLogP6.70
TPSA293.44 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds
Heavy Atoms75
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001013.24
LogP ≤ 56.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole?
The IUPAC name of 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole (CID 158191016) is 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole.
What is the SMILES notation for 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole?
The canonical SMILES for 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole is Cc1ccccn1.Cc1cccnc1.Cc1cccnn1.Cc1ccnnc1.Cc1cnccn1.Cc1cncnc1.Cc1cncnn1.Cc1ncccn1.Cc1nccnn1.Cn1cncn1.Cn1cnnc1.
What is the InChIKey of 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole?
The InChIKey is FZTDTBVJPGBXPN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H7N.5C5H6N2.2C4H5N3.2C3H5N3/c1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-5-2-6-4-7-3-5;1-5-4-6-2-3-7-5;1-5-2-3-6-7-4-5;1-5-6-3-2-4-7-5;1-5-3-2-4-6-7-5;1-4-2-5-3-6-7-4;1-4-5-2-3-6-7-4;1-6-2-4-5-3-6;1-6-3-4-2-5-6/h2*2-5H,1H3;5*2-4H,1H3;2*2-3H,1H3;2*2-3H,1H3.
What are the key properties of 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole?
2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole has a molecular weight of 1013.24 g/mol, XLogP of 6.70, 0 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;5-methylpyrimidine;3-methyl-1,2,4-triazine;6-methyl-1,2,4-triazine;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole is sourced from PubChem (CID 158191016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).