N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide

C15H15N5O3S — CID 25129386

IUPACN-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1nc2ccc(-c3cccc(NS(C)(=O)=O)c3)cn2n1
InChIInChI=1S/C15H15N5O3S/c1-10(21)16-15-17-14-7-6-12(9-20(14)18-15)11-4-3-5-13(8-11)19-24(2,22)23/h3-9,19H,1-2H3,(H,16,18,21)
InChIKeyXIROYTWPIXJVRC-UHFFFAOYSA-N
MW345.38 g/mol
LogP1.73
Rot. Bonds4

About N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide

N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide (PubChem CID 25129386) has the molecular formula C15H15N5O3S and a molecular weight of 345.38 g/mol. Its IUPAC name is N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
PubChem CID25129386
Molecular FormulaC15H15N5O3S
Molecular Weight345.38 g/mol
Exact Mass345.09
IUPAC NameN-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1nc2ccc(-c3cccc(NS(C)(=O)=O)c3)cn2n1
InChIInChI=1S/C15H15N5O3S/c1-10(21)16-15-17-14-7-6-12(9-20(14)18-15)11-4-3-5-13(8-11)19-24(2,22)23/h3-9,19H,1-2H3,(H,16,18,21)
InChIKeyXIROYTWPIXJVRC-UHFFFAOYSA-N
XLogP1.73
TPSA105.46 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.38
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The IUPAC name of N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide (CID 25129386) is N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide.
What is the SMILES notation for N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The canonical SMILES for N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide is CC(=O)Nc1nc2ccc(-c3cccc(NS(C)(=O)=O)c3)cn2n1.
What is the InChIKey of N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The InChIKey is XIROYTWPIXJVRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O3S/c1-10(21)16-15-17-14-7-6-12(9-20(14)18-15)11-4-3-5-13(8-11)19-24(2,22)23/h3-9,19H,1-2H3,(H,16,18,21).
What are the key properties of N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide has a molecular weight of 345.38 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide is sourced from PubChem (CID 25129386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).