N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide

C16H16N4O3S — CID 53190674

IUPACN-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2cccn3nc(C4CC4)nc23)cc1
InChIInChI=1S/C16H16N4O3S/c1-23-12-6-8-13(9-7-12)24(21,22)19-14-3-2-10-20-16(14)17-15(18-20)11-4-5-11/h2-3,6-11,19H,4-5H2,1H3
InChIKeyQOADIWPDUZRCCI-UHFFFAOYSA-N
MW344.40 g/mol
LogP2.42
Rot. Bonds5

About N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide

N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide (PubChem CID 53190674) has the molecular formula C16H16N4O3S and a molecular weight of 344.40 g/mol. Its IUPAC name is N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide
PubChem CID53190674
Molecular FormulaC16H16N4O3S
Molecular Weight344.40 g/mol
Exact Mass344.09
IUPAC NameN-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2cccn3nc(C4CC4)nc23)cc1
InChIInChI=1S/C16H16N4O3S/c1-23-12-6-8-13(9-7-12)24(21,22)19-14-3-2-10-20-16(14)17-15(18-20)11-4-5-11/h2-3,6-11,19H,4-5H2,1H3
InChIKeyQOADIWPDUZRCCI-UHFFFAOYSA-N
XLogP2.42
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.40
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-bromo-N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide
CID 87054170
N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methylbenzenesulfonamide
CID 53190700
4-methoxy-N-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide
CID 53190641
N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 53190679
5-chloro-N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)thiophene-2-sulfonamide
CID 87054168
4-methoxy-N-pyrrolo[1,2-a]quinolin-6-ylbenzenesulfonamide
CID 3438491
methyl 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
CID 117137744
N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide
CID 53190518
N-(2-fluorophenyl)-4-methoxybenzenesulfonamide
CID 711138
4-methoxy-N-(5-methoxy-2-methylphenyl)benzenesulfonamide
CID 4564561
N-[2-[(4-methoxyphenyl)sulfonylamino]phenyl]formamide
CID 15294855
4-methoxy-N-[2-(pyrimidin-2-ylamino)phenyl]benzenesulfonamide
CID 15293859

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide?
The IUPAC name of N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide (CID 53190674) is N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide.
What is the SMILES notation for N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide?
The canonical SMILES for N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2cccn3nc(C4CC4)nc23)cc1.
What is the InChIKey of N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide?
The InChIKey is QOADIWPDUZRCCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O3S/c1-23-12-6-8-13(9-7-12)24(21,22)19-14-3-2-10-20-16(14)17-15(18-20)11-4-5-11/h2-3,6-11,19H,4-5H2,1H3.
What are the key properties of N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide?
N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide has a molecular weight of 344.40 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-methoxybenzenesulfonamide is sourced from PubChem (CID 53190674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).