N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide

C11H17N5O2S — CID 106339224

IUPACN,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide
SMILESCc1cc(NCCS(=O)(=O)N(C)C)n2ncnc2c1
InChIInChI=1S/C11H17N5O2S/c1-9-6-10(16-11(7-9)13-8-14-16)12-4-5-19(17,18)15(2)3/h6-8,12H,4-5H2,1-3H3
InChIKeyKUVDSKJGFQBWFD-UHFFFAOYSA-N
MW283.36 g/mol
LogP0.34
Rot. Bonds5

About N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide

N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide (PubChem CID 106339224) has the molecular formula C11H17N5O2S and a molecular weight of 283.36 g/mol. Its IUPAC name is N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide
PubChem CID106339224
Molecular FormulaC11H17N5O2S
Molecular Weight283.36 g/mol
Exact Mass283.11
IUPAC NameN,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide
SMILESCc1cc(NCCS(=O)(=O)N(C)C)n2ncnc2c1
InChIInChI=1S/C11H17N5O2S/c1-9-6-10(16-11(7-9)13-8-14-16)12-4-5-19(17,18)15(2)3/h6-8,12H,4-5H2,1-3H3
InChIKeyKUVDSKJGFQBWFD-UHFFFAOYSA-N
XLogP0.34
TPSA79.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide?
The IUPAC name of N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide (CID 106339224) is N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide.
What is the SMILES notation for N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide?
The canonical SMILES for N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide is Cc1cc(NCCS(=O)(=O)N(C)C)n2ncnc2c1.
What is the InChIKey of N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide?
The InChIKey is KUVDSKJGFQBWFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2S/c1-9-6-10(16-11(7-9)13-8-14-16)12-4-5-19(17,18)15(2)3/h6-8,12H,4-5H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide?
N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide has a molecular weight of 283.36 g/mol, XLogP of 0.34, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]ethanesulfonamide is sourced from PubChem (CID 106339224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).