N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide

C17H19N5O3S — CID 75392092

IUPACN-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide
SMILESCOCCn1cc(S(=O)(=O)Nc2cccnc2Nc2ccccc2)cn1
InChIInChI=1S/C17H19N5O3S/c1-25-11-10-22-13-15(12-19-22)26(23,24)21-16-8-5-9-18-17(16)20-14-6-3-2-4-7-14/h2-9,12-13,21H,10-11H2,1H3,(H,18,20)
InChIKeyCPXLXGMMCJPLCZ-UHFFFAOYSA-N
MW373.44 g/mol
LogP2.47
Rot. Bonds8

About N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide

N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide (PubChem CID 75392092) has the molecular formula C17H19N5O3S and a molecular weight of 373.44 g/mol. Its IUPAC name is N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide
PubChem CID75392092
Molecular FormulaC17H19N5O3S
Molecular Weight373.44 g/mol
Exact Mass373.12
IUPAC NameN-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide
SMILESCOCCn1cc(S(=O)(=O)Nc2cccnc2Nc2ccccc2)cn1
InChIInChI=1S/C17H19N5O3S/c1-25-11-10-22-13-15(12-19-22)26(23,24)21-16-8-5-9-18-17(16)20-14-6-3-2-4-7-14/h2-9,12-13,21H,10-11H2,1H3,(H,18,20)
InChIKeyCPXLXGMMCJPLCZ-UHFFFAOYSA-N
XLogP2.47
TPSA98.14 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.44
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyridine-2-sulfonamide
CID 103301171
2-[[1-(2-methoxyethyl)pyrazol-4-yl]amino]pyridine-3-carbonitrile
CID 60967015
N-[1-(2-methoxyethyl)pyrazol-4-yl]quinoline-6-sulfonamide
CID 154838624
N-(4-hydroxy-3,4-dihydro-2H-chromen-8-yl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide
CID 126805654
4-hydroxy-N-[2-(4-methoxyanilino)-3-pyridinyl]benzenesulfonamide
CID 15294805
1-(2-aminoethyl)-N-(2-chlorophenyl)pyrazole-4-sulfonamide
CID 106061816
1-(2-aminoethyl)-N-pyridin-3-ylpyrazole-4-sulfonamide
CID 114138925
[4-[[3-[(4-methoxyphenyl)sulfonylamino]-2-pyridinyl]amino]phenyl] hydrogen sulfate
CID 15294822
4-ethoxy-N-[2-(4-hydroxyanilino)-3-pyridinyl]benzenesulfonamide
CID 15294863
3-[4-(pyrimidin-2-ylsulfamoyl)pyrazol-1-yl]propanoic acid
CID 43513624
2-[4-[(2-methylphenyl)sulfamoyl]pyrazol-1-yl]acetic acid
CID 43511079
1-[2-(propan-2-ylamino)ethyl]-N-pyridin-3-ylpyrazole-4-sulfonamide
CID 106033533

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide?
The IUPAC name of N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide (CID 75392092) is N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide.
What is the SMILES notation for N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide?
The canonical SMILES for N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide is COCCn1cc(S(=O)(=O)Nc2cccnc2Nc2ccccc2)cn1.
What is the InChIKey of N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide?
The InChIKey is CPXLXGMMCJPLCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O3S/c1-25-11-10-22-13-15(12-19-22)26(23,24)21-16-8-5-9-18-17(16)20-14-6-3-2-4-7-14/h2-9,12-13,21H,10-11H2,1H3,(H,18,20).
What are the key properties of N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide?
N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide has a molecular weight of 373.44 g/mol, XLogP of 2.47, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-3-pyridinyl)-1-(2-methoxyethyl)pyrazole-4-sulfonamide is sourced from PubChem (CID 75392092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).