6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide

C15H21N5O3S — CID 57402323

IUPAC6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide
SMILESCc1nn(C)c(C)c1NS(=O)(=O)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C15H21N5O3S/c1-11-15(12(2)19(3)17-11)18-24(21,22)13-4-5-14(16-10-13)20-6-8-23-9-7-20/h4-5,10,18H,6-9H2,1-3H3
InChIKeyPIJLLBAUTCQNEB-UHFFFAOYSA-N
MW351.43 g/mol
LogP1.07
Rot. Bonds4

About 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide

6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide (PubChem CID 57402323) has the molecular formula C15H21N5O3S and a molecular weight of 351.43 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide
PubChem CID57402323
Molecular FormulaC15H21N5O3S
Molecular Weight351.43 g/mol
Exact Mass351.14
IUPAC Name6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide
SMILESCc1nn(C)c(C)c1NS(=O)(=O)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C15H21N5O3S/c1-11-15(12(2)19(3)17-11)18-24(21,22)13-4-5-14(16-10-13)20-6-8-23-9-7-20/h4-5,10,18H,6-9H2,1-3H3
InChIKeyPIJLLBAUTCQNEB-UHFFFAOYSA-N
XLogP1.07
TPSA89.35 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

Imidazo[1,2-b]pyridazine deriv. 2c
CID 6539039
6-{[2-(4-Methylpiperazin-1-Yl)ethyl]amino}-N-(1,3,5-Trimethyl-1h-Pyrazol-4-Yl)pyridine-3-Sulfonamide
CID 46179030
Imidazo[1,2-b]pyridazine deriv. 4b
CID 6539044
US9156811, Ddd85624
CID 57393582
US9156811, Ddd87757
CID 57395296
US9156811, Ddd86298
CID 57397062
US9156811, Ddd86301
CID 57397063
US9156811, Ddd88000
CID 57398842
US9156811, Ddd88008
CID 57398843
US9156811, Ddd85627
CID 57402325
US9156811, Ddd86305
CID 57404042
US9156811, Ddd86310
CID 57404043

Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide (CID 57402323) is 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide is Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(N2CCOCC2)nc1.
What is the InChIKey of 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide?
The InChIKey is PIJLLBAUTCQNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O3S/c1-11-15(12(2)19(3)17-11)18-24(21,22)13-4-5-14(16-10-13)20-6-8-23-9-7-20/h4-5,10,18H,6-9H2,1-3H3.
What are the key properties of 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide?
6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide has a molecular weight of 351.43 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 57402323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).