6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one

C11H15N3O — CID 165478940

IUPAC6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
SMILESCCCc1nc2cc(C)c(C)c(=O)n2[nH]1
InChIInChI=1S/C11H15N3O/c1-4-5-9-12-10-6-7(2)8(3)11(15)14(10)13-9/h6H,4-5H2,1-3H3,(H,12,13)
InChIKeyRZDRGBDZRBJJSN-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.59
Rot. Bonds2

About 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one

6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one (PubChem CID 165478940) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one.

Molecular Properties

Compound Name6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
PubChem CID165478940
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
SMILESCCCc1nc2cc(C)c(C)c(=O)n2[nH]1
InChIInChI=1S/C11H15N3O/c1-4-5-9-12-10-6-7(2)8(3)11(15)14(10)13-9/h6H,4-5H2,1-3H3,(H,12,13)
InChIKeyRZDRGBDZRBJJSN-UHFFFAOYSA-N
XLogP1.59
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The IUPAC name of 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one (CID 165478940) is 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one.
What is the SMILES notation for 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The canonical SMILES for 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one is CCCc1nc2cc(C)c(C)c(=O)n2[nH]1.
What is the InChIKey of 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The InChIKey is RZDRGBDZRBJJSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-4-5-9-12-10-6-7(2)8(3)11(15)14(10)13-9/h6H,4-5H2,1-3H3,(H,12,13).
What are the key properties of 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one has a molecular weight of 205.26 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-2-propyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one is sourced from PubChem (CID 165478940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).