2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide

C17H23N3O2S — CID 124892659

IUPAC2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)N[C@@H]2CCn3nccc3C2)c1C
InChIInChI=1S/C17H23N3O2S/c1-11-9-12(2)14(4)17(13(11)3)23(21,22)19-15-6-8-20-16(10-15)5-7-18-20/h5,7,9,15,19H,6,8,10H2,1-4H3/t15-/m1/s1
InChIKeyUQZAPZRYTYKMHH-OAHLLOKOSA-N
MW333.46 g/mol
LogP2.41
Rot. Bonds3

About 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide

2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide (PubChem CID 124892659) has the molecular formula C17H23N3O2S and a molecular weight of 333.46 g/mol. Its IUPAC name is 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide.

Molecular Properties

Compound Name2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide
PubChem CID124892659
Molecular FormulaC17H23N3O2S
Molecular Weight333.46 g/mol
Exact Mass333.15
IUPAC Name2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)N[C@@H]2CCn3nccc3C2)c1C
InChIInChI=1S/C17H23N3O2S/c1-11-9-12(2)14(4)17(13(11)3)23(21,22)19-15-6-8-20-16(10-15)5-7-18-20/h5,7,9,15,19H,6,8,10H2,1-4H3/t15-/m1/s1
InChIKeyUQZAPZRYTYKMHH-OAHLLOKOSA-N
XLogP2.41
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.46
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl)benzenesulfonamide
CID 121018792
2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl)-4,5,6,7-tetrahydroindazole-3-sulfonamide
CID 138018471
N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide
CID 124760322
N-cyclobutyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-amine
CID 121185160
2-[methyl(methylsulfonyl)amino]-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl)acetamide
CID 119101484
3-amino-N-cyclopropyl-2,5,6-trimethylbenzenesulfonamide
CID 106503553
N-[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 124892973
methyl 4-[[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]carbamoyl]benzoate
CID 124725421
3-fluoro-4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl)benzamide
CID 119101493
2,3,5,6-tetramethyl-N-(2-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120586042
[4-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]carbamoyl]phenyl] acetate
CID 124759602
2-methylsulfanyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzamide
CID 124760369

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide?
The IUPAC name of 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide (CID 124892659) is 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide.
What is the SMILES notation for 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide?
The canonical SMILES for 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide is Cc1cc(C)c(C)c(S(=O)(=O)N[C@@H]2CCn3nccc3C2)c1C.
What is the InChIKey of 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide?
The InChIKey is UQZAPZRYTYKMHH-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H23N3O2S/c1-11-9-12(2)14(4)17(13(11)3)23(21,22)19-15-6-8-20-16(10-15)5-7-18-20/h5,7,9,15,19H,6,8,10H2,1-4H3/t15-/m1/s1.
What are the key properties of 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide?
2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide has a molecular weight of 333.46 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetramethyl-N-[(5R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]benzenesulfonamide is sourced from PubChem (CID 124892659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).