1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide

C17H17FN4O2S — CID 90588515

IUPAC1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1F)NCCn1ccc(-c2ccccn2)n1
InChIInChI=1S/C17H17FN4O2S/c18-15-6-2-1-5-14(15)13-25(23,24)20-10-12-22-11-8-17(21-22)16-7-3-4-9-19-16/h1-9,11,20H,10,12-13H2
InChIKeyUJWQIUCEVKJOMN-UHFFFAOYSA-N
MW360.41 g/mol
LogP2.20
Rot. Bonds7

About 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide

1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide (PubChem CID 90588515) has the molecular formula C17H17FN4O2S and a molecular weight of 360.41 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide
PubChem CID90588515
Molecular FormulaC17H17FN4O2S
Molecular Weight360.41 g/mol
Exact Mass360.11
IUPAC Name1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1F)NCCn1ccc(-c2ccccn2)n1
InChIInChI=1S/C17H17FN4O2S/c18-15-6-2-1-5-14(15)13-25(23,24)20-10-12-22-11-8-17(21-22)16-7-3-4-9-19-16/h1-9,11,20H,10,12-13H2
InChIKeyUJWQIUCEVKJOMN-UHFFFAOYSA-N
XLogP2.20
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]benzamide
CID 90588267
2-chloro-6-fluoro-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]benzamide
CID 90588310
1-(2-chlorophenyl)-N-[2-(3-pyridin-4-ylpyrazol-1-yl)ethyl]methanesulfonamide
CID 90588160
1-(2,5-difluorophenyl)-N-[2-(2-pyridin-2-ylimidazol-1-yl)ethyl]methanesulfonamide
CID 86266172
1-(2-fluorophenyl)-N-(5-pyridin-2-yl-2-pyridinyl)methanesulfonamide
CID 75522843
N-[4-[2-(3-pyridin-2-ylpyrazol-1-yl)ethylsulfamoyl]phenyl]acetamide
CID 90588452
lead(2+);2-[1-[3-(3-pyridin-2-ylpyrazol-1-yl)propyl]pyrazol-3-yl]pyridine;dinitrate
CID 139162818
4-methyl-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]benzamide
CID 90588265
4-phenyl-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]benzamide
CID 90588347
5-ethyl-2-methoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]benzenesulfonamide
CID 90588458
4-methyl-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]thiophene-2-carboxamide
CID 90588269
3,3-dimethyl-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]butanamide
CID 90588258

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide?
The IUPAC name of 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide (CID 90588515) is 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide is O=S(=O)(Cc1ccccc1F)NCCn1ccc(-c2ccccn2)n1.
What is the InChIKey of 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide?
The InChIKey is UJWQIUCEVKJOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN4O2S/c18-15-6-2-1-5-14(15)13-25(23,24)20-10-12-22-11-8-17(21-22)16-7-3-4-9-19-16/h1-9,11,20H,10,12-13H2.
What are the key properties of 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide?
1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide has a molecular weight of 360.41 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]methanesulfonamide is sourced from PubChem (CID 90588515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).