7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine

C7H9N3 — CID 123806825

IUPAC7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC1C=Cn2cnnc2C1
InChIInChI=1S/C7H9N3/c1-6-2-3-10-5-8-9-7(10)4-6/h2-3,5-6H,4H2,1H3
InChIKeyIAAYHTNFGZRMSH-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.94
Rot. Bonds

About 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine

7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 123806825) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID123806825
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC1C=Cn2cnnc2C1
InChIInChI=1S/C7H9N3/c1-6-2-3-10-5-8-9-7(10)4-6/h2-3,5-6H,4H2,1H3
InChIKeyIAAYHTNFGZRMSH-UHFFFAOYSA-N
XLogP0.94
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-Allyl-4-methyl-1,2,4-triazole
CID 129875053
3-Methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 59299764
2-Methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 68072983
3-methyl-4-[(1Z)-3-methylbuta-1,3-dienyl]-1,2,4-triazole
CID 89145136
2,8-Dimethyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 89603927
7,8-Dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 117906456
7,7-dimethyl-8H-[1,2,4]triazolo[1,5-a]pyridine
CID 118030086
7,8-Dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 118369185
4-Buta-1,3-dienyl-3-methyl-1,2,4-triazole
CID 123802732
1-(2-Ethylbuta-1,3-dienyl)-5-propyl-1,2,4-triazole
CID 123994001
3-Ethyl-4-prop-1-enyl-1,2,4-triazole
CID 124014672
4-(4-methylpent-1-en-2-yl)-3-[(Z)-prop-1-enyl]-1,2,4-triazole
CID 131974317

Frequently Asked Questions

What is the IUPAC name of 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine (CID 123806825) is 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine is CC1C=Cn2cnnc2C1.
What is the InChIKey of 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is IAAYHTNFGZRMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-6-2-3-10-5-8-9-7(10)4-6/h2-3,5-6H,4H2,1H3.
What are the key properties of 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 135.17 g/mol, XLogP of 0.94, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 123806825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).