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

C14H14N6O3S — CID 70692914

IUPACN-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1nc2ccc(-c3cncc(CS(N)(=O)=O)c3)cn2n1
InChIInChI=1S/C14H14N6O3S/c1-9(21)17-14-18-13-3-2-11(7-20(13)19-14)12-4-10(5-16-6-12)8-24(15,22)23/h2-7H,8H2,1H3,(H2,15,22,23)(H,17,19,21)
InChIKeyCCONYACVDITNCM-UHFFFAOYSA-N
MW346.37 g/mol
LogP0.54
Rot. Bonds4

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

N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide (PubChem CID 70692914) has the molecular formula C14H14N6O3S and a molecular weight of 346.37 g/mol. Its IUPAC name is N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
PubChem CID70692914
Molecular FormulaC14H14N6O3S
Molecular Weight346.37 g/mol
Exact Mass346.08
IUPAC NameN-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1nc2ccc(-c3cncc(CS(N)(=O)=O)c3)cn2n1
InChIInChI=1S/C14H14N6O3S/c1-9(21)17-14-18-13-3-2-11(7-20(13)19-14)12-4-10(5-16-6-12)8-24(15,22)23/h2-7H,8H2,1H3,(H2,15,22,23)(H,17,19,21)
InChIKeyCCONYACVDITNCM-UHFFFAOYSA-N
XLogP0.54
TPSA132.34 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.37
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The IUPAC name of N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide (CID 70692914) is N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide.
What is the SMILES notation for N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The canonical SMILES for N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide is CC(=O)Nc1nc2ccc(-c3cncc(CS(N)(=O)=O)c3)cn2n1.
What is the InChIKey of N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The InChIKey is CCONYACVDITNCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6O3S/c1-9(21)17-14-18-13-3-2-11(7-20(13)19-14)12-4-10(5-16-6-12)8-24(15,22)23/h2-7H,8H2,1H3,(H2,15,22,23)(H,17,19,21).
What are the key properties of N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide has a molecular weight of 346.37 g/mol, XLogP of 0.54, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[5-(sulfamoylmethyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide is sourced from PubChem (CID 70692914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).