6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine

C17H22N6O2S — CID 168798012

IUPAC6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1cc2ncnn2cc1C1CCN(S(=O)(=O)c2cnn(C)c2C)CC1
InChIInChI=1S/C17H22N6O2S/c1-12-8-17-18-11-20-23(17)10-15(12)14-4-6-22(7-5-14)26(24,25)16-9-19-21(3)13(16)2/h8-11,14H,4-7H2,1-3H3
InChIKeyIDXDUZLWILZAMV-UHFFFAOYSA-N
MW374.47 g/mol
LogP1.65
Rot. Bonds3

About 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine

6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 168798012) has the molecular formula C17H22N6O2S and a molecular weight of 374.47 g/mol. Its IUPAC name is 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID168798012
Molecular FormulaC17H22N6O2S
Molecular Weight374.47 g/mol
Exact Mass374.15
IUPAC Name6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1cc2ncnn2cc1C1CCN(S(=O)(=O)c2cnn(C)c2C)CC1
InChIInChI=1S/C17H22N6O2S/c1-12-8-17-18-11-20-23(17)10-15(12)14-4-6-22(7-5-14)26(24,25)16-9-19-21(3)13(16)2/h8-11,14H,4-7H2,1-3H3
InChIKeyIDXDUZLWILZAMV-UHFFFAOYSA-N
XLogP1.65
TPSA85.39 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.47
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine (CID 168798012) is 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine is Cc1cc2ncnn2cc1C1CCN(S(=O)(=O)c2cnn(C)c2C)CC1.
What is the InChIKey of 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is IDXDUZLWILZAMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6O2S/c1-12-8-17-18-11-20-23(17)10-15(12)14-4-6-22(7-5-14)26(24,25)16-9-19-21(3)13(16)2/h8-11,14H,4-7H2,1-3H3.
What are the key properties of 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 374.47 g/mol, XLogP of 1.65, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 168798012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).