N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide

C19H23N3O5S2 — CID 178185144

IUPACN-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide
SMILESCOc1ccc(-c2cnn3ccc(S(=O)(=O)C(C)(C)C)cc23)cc1NS(C)(=O)=O
InChIInChI=1S/C19H23N3O5S2/c1-19(2,3)29(25,26)14-8-9-22-17(11-14)15(12-20-22)13-6-7-18(27-4)16(10-13)21-28(5,23)24/h6-12,21H,1-5H3
InChIKeySWOGYKJSXYSXGJ-UHFFFAOYSA-N
MW437.54 g/mol
LogP2.95
Rot. Bonds5

About N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide

N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide (PubChem CID 178185144) has the molecular formula C19H23N3O5S2 and a molecular weight of 437.54 g/mol. Its IUPAC name is N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide
PubChem CID178185144
Molecular FormulaC19H23N3O5S2
Molecular Weight437.54 g/mol
Exact Mass437.11
IUPAC NameN-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide
SMILESCOc1ccc(-c2cnn3ccc(S(=O)(=O)C(C)(C)C)cc23)cc1NS(C)(=O)=O
InChIInChI=1S/C19H23N3O5S2/c1-19(2,3)29(25,26)14-8-9-22-17(11-14)15(12-20-22)13-6-7-18(27-4)16(10-13)21-28(5,23)24/h6-12,21H,1-5H3
InChIKeySWOGYKJSXYSXGJ-UHFFFAOYSA-N
XLogP2.95
TPSA106.84 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.54
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide with MolForge

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Related Compounds

2-[4-(5-methoxypyrazolo[1,5-a]pyridin-3-yl)anilino]ethanol
CID 71242933
N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide
CID 122191039
N-[3-(methanesulfonamido)-4-methoxyphenyl]-4-methylbenzenesulfonamide
CID 169373450
methyl 3-(methanesulfonamido)-4-methoxybenzoate
CID 5303011
N-(2,5-dimethoxyphenyl)-5-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-2-methylbenzenesulfonamide
CID 46394920
N-[2-(4-methoxyphenyl)phenyl]methanesulfonamide
CID 23508536
N-(6-methoxy-1,3-dimethyl-2-oxobenzimidazol-5-yl)methanesulfonamide
CID 22434010
N-[2-methoxy-5-[3-[1-(1-phenylethyl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanesulfonamide
CID 154119487
N-(5-chloro-2-methoxyphenyl)-5-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-2-methoxybenzenesulfonamide
CID 50838835
4-[2-(3,4-dimethoxyphenyl)ethylamino]-5-(4-methylsulfonylphenyl)-2-(2,2,2-trifluoroethylsulfonyl)pyridazin-3-one
CID 70213221
3-(tert-butylsulfamoylamino)-4-methoxybenzenesulfonamide
CID 114812448
4-tert-butyl-2-(dimethylsulfamoylamino)-1-methoxybenzene
CID 110776709

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide?
The IUPAC name of N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide (CID 178185144) is N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide.
What is the SMILES notation for N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide?
The canonical SMILES for N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide is COc1ccc(-c2cnn3ccc(S(=O)(=O)C(C)(C)C)cc23)cc1NS(C)(=O)=O.
What is the InChIKey of N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide?
The InChIKey is SWOGYKJSXYSXGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O5S2/c1-19(2,3)29(25,26)14-8-9-22-17(11-14)15(12-20-22)13-6-7-18(27-4)16(10-13)21-28(5,23)24/h6-12,21H,1-5H3.
What are the key properties of N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide?
N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide has a molecular weight of 437.54 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-tert-butylsulfonylpyrazolo[1,5-a]pyridin-3-yl)-2-methoxyphenyl]methanesulfonamide is sourced from PubChem (CID 178185144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).