7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one

C7H7N3O — CID 4855592

IUPAC7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
SMILESCc1cc(=O)n2[nH]cnc2c1
InChIInChI=1S/C7H7N3O/c1-5-2-6-8-4-9-10(6)7(11)3-5/h2-4H,1H3,(H,8,9)
InChIKeyVLZYFKSIVQROCE-UHFFFAOYSA-N
MW149.15 g/mol
LogP0.33
Rot. Bonds

About 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one

7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one (PubChem CID 4855592) has the molecular formula C7H7N3O and a molecular weight of 149.15 g/mol. Its IUPAC name is 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one.

Molecular Properties

Compound Name7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
PubChem CID4855592
Molecular FormulaC7H7N3O
Molecular Weight149.15 g/mol
Exact Mass149.06
IUPAC Name7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
SMILESCc1cc(=O)n2[nH]cnc2c1
InChIInChI=1S/C7H7N3O/c1-5-2-6-8-4-9-10(6)7(11)3-5/h2-4H,1H3,(H,8,9)
InChIKeyVLZYFKSIVQROCE-UHFFFAOYSA-N
XLogP0.33
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The IUPAC name of 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one (CID 4855592) is 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one.
What is the SMILES notation for 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The canonical SMILES for 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one is Cc1cc(=O)n2[nH]cnc2c1.
What is the InChIKey of 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The InChIKey is VLZYFKSIVQROCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O/c1-5-2-6-8-4-9-10(6)7(11)3-5/h2-4H,1H3,(H,8,9).
What are the key properties of 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one has a molecular weight of 149.15 g/mol, XLogP of 0.33, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one is sourced from PubChem (CID 4855592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).