4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine

C22H22N8 — CID 144921007

IUPAC4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccc2ccnn2c1.Cc1ccn2ncnc2c1.Cc1nccc2[nH]cnc12
InChIInChI=1S/C8H8N2.2C7H7N3/c1-7-2-3-8-4-5-9-10(8)6-7;1-6-2-3-10-7(4-6)8-5-9-10;1-5-7-6(2-3-8-5)9-4-10-7/h2-6H,1H3;2-5H,1H3;2-4H,1H3,(H,9,10)
InChIKeyDJVSSPWAYZDBNA-UHFFFAOYSA-N
MW398.47 g/mol
LogP3.95
Rot. Bonds

About 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine

4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 144921007) has the molecular formula C22H22N8 and a molecular weight of 398.47 g/mol. Its IUPAC name is 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID144921007
Molecular FormulaC22H22N8
Molecular Weight398.47 g/mol
Exact Mass398.20
IUPAC Name4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccc2ccnn2c1.Cc1ccn2ncnc2c1.Cc1nccc2[nH]cnc12
InChIInChI=1S/C8H8N2.2C7H7N3/c1-7-2-3-8-4-5-9-10(8)6-7;1-6-2-3-10-7(4-6)8-5-9-10;1-5-7-6(2-3-8-5)9-4-10-7/h2-6H,1H3;2-5H,1H3;2-4H,1H3,(H,9,10)
InChIKeyDJVSSPWAYZDBNA-UHFFFAOYSA-N
XLogP3.95
TPSA89.06 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine (CID 144921007) is 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine is Cc1ccc2ccnn2c1.Cc1ccn2ncnc2c1.Cc1nccc2[nH]cnc12.
What is the InChIKey of 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is DJVSSPWAYZDBNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2.2C7H7N3/c1-7-2-3-8-4-5-9-10(8)6-7;1-6-2-3-10-7(4-6)8-5-9-10;1-5-7-6(2-3-8-5)9-4-10-7/h2-6H,1H3;2-5H,1H3;2-4H,1H3,(H,9,10).
What are the key properties of 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 398.47 g/mol, XLogP of 3.95, 0 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1H-imidazo[4,5-c]pyridine;6-methylpyrazolo[1,5-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 144921007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).