N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide

C16H18N4O3S — CID 126796741

IUPACN-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide
SMILESCc1ccn2ncnc2c1NS(=O)(=O)c1ccc(OC(C)C)cc1
InChIInChI=1S/C16H18N4O3S/c1-11(2)23-13-4-6-14(7-5-13)24(21,22)19-15-12(3)8-9-20-16(15)17-10-18-20/h4-11,19H,1-3H3
InChIKeyPCYKIEAPNOYNKO-UHFFFAOYSA-N
MW346.41 g/mol
LogP2.63
Rot. Bonds5

About N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide

N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide (PubChem CID 126796741) has the molecular formula C16H18N4O3S and a molecular weight of 346.41 g/mol. Its IUPAC name is N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide.

Molecular Properties

Compound NameN-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide
PubChem CID126796741
Molecular FormulaC16H18N4O3S
Molecular Weight346.41 g/mol
Exact Mass346.11
IUPAC NameN-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide
SMILESCc1ccn2ncnc2c1NS(=O)(=O)c1ccc(OC(C)C)cc1
InChIInChI=1S/C16H18N4O3S/c1-11(2)23-13-4-6-14(7-5-13)24(21,22)19-15-12(3)8-9-20-16(15)17-10-18-20/h4-11,19H,1-3H3
InChIKeyPCYKIEAPNOYNKO-UHFFFAOYSA-N
XLogP2.63
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide with MolForge

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Related Compounds

N-(5-methyl-2H-triazol-4-yl)-4-propan-2-yloxybenzenesulfonamide
CID 126828292
N-[2-[(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide
CID 113093731
N-(4-cyano-1,3-dimethylpyrazol-5-yl)-4-propan-2-yloxybenzenesulfonamide
CID 126833875
4-(4-propan-2-yloxyphenoxy)benzenesulfonyl chloride
CID 16740705
4-propan-2-yloxy-N-quinolin-3-ylbenzenesulfonamide
CID 110730295
N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]-4-propan-2-yloxybenzenesulfonamide
CID 112990448
methyl 2-[(4-propan-2-yloxyphenyl)sulfonylamino]benzoate
CID 110756559
4-propan-2-yloxy-N-(2-pyrrol-1-ylethyl)benzenesulfonamide
CID 110716379
N-[4-(3-methylbutylamino)phenyl]-4-propan-2-yloxybenzenesulfonamide
CID 112985174
N-(1-hydroxy-2-methylpropan-2-yl)-4-propan-2-yloxybenzenesulfonamide
CID 39389642
ethyl 2-[(4-propan-2-yloxyphenyl)sulfonylamino]-1,3-oxazole-4-carboxylate
CID 84563770
N-[5-(cyclopentylamino)-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide
CID 113024552

Frequently Asked Questions

What is the IUPAC name of N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide?
The IUPAC name of N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide (CID 126796741) is N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide.
What is the SMILES notation for N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide?
The canonical SMILES for N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide is Cc1ccn2ncnc2c1NS(=O)(=O)c1ccc(OC(C)C)cc1.
What is the InChIKey of N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide?
The InChIKey is PCYKIEAPNOYNKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3S/c1-11(2)23-13-4-6-14(7-5-13)24(21,22)19-15-12(3)8-9-20-16(15)17-10-18-20/h4-11,19H,1-3H3.
What are the key properties of N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide?
N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide has a molecular weight of 346.41 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-4-propan-2-yloxybenzenesulfonamide is sourced from PubChem (CID 126796741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).