1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide

C18H17FN4O3S — CID 75466680

IUPAC1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide
SMILESCC(NC(=O)c1ccn(-c2ccccc2F)n1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C18H17FN4O3S/c1-12(13-6-8-14(9-7-13)27(20,25)26)21-18(24)16-10-11-23(22-16)17-5-3-2-4-15(17)19/h2-12H,1H3,(H,21,24)(H2,20,25,26)
InChIKeyNOGYINAINWLFTN-UHFFFAOYSA-N
MW388.42 g/mol
LogP2.15
Rot. Bonds5

About 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide

1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide (PubChem CID 75466680) has the molecular formula C18H17FN4O3S and a molecular weight of 388.42 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide
PubChem CID75466680
Molecular FormulaC18H17FN4O3S
Molecular Weight388.42 g/mol
Exact Mass388.10
IUPAC Name1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide
SMILESCC(NC(=O)c1ccn(-c2ccccc2F)n1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C18H17FN4O3S/c1-12(13-6-8-14(9-7-13)27(20,25)26)21-18(24)16-10-11-23(22-16)17-5-3-2-4-15(17)19/h2-12H,1H3,(H,21,24)(H2,20,25,26)
InChIKeyNOGYINAINWLFTN-UHFFFAOYSA-N
XLogP2.15
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-4-carboxamide
CID 75526443
1-(2-fluorophenyl)-N'-(2-methylpropanoyl)pyrazole-3-carbohydrazide
CID 78863955
1-(2-fluorophenyl)-N-[2-(methylamino)propyl]pyrazole-3-carboxamide
CID 120827733
N-[4-(diethylsulfamoyl)phenyl]-1-(2-fluorophenyl)pyrazole-3-carboxamide
CID 78868746
1-(2-fluorophenyl)-N-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 78869937
2-cyclopropyl-2-[[1-(2-fluorophenyl)pyrazole-3-carbonyl]amino]acetic acid
CID 119213154
N-[(1S)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-1-(2-fluorophenyl)pyrazole-3-carboxamide
CID 98774835
1-(2-fluorophenyl)-N-(4-hydroxy-2-methylpentyl)pyrazole-3-carboxamide
CID 111447765
5-chloro-2-fluoro-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 27759607
N-[1-(4-sulfamoylphenyl)ethyl]-2H-triazole-4-carboxamide
CID 112732641
1-(2-fluorophenyl)-N-(4-hydroxy-2,2-dimethylpentyl)pyrazole-3-carboxamide
CID 111480425
3-amino-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 43702371

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide?
The IUPAC name of 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide (CID 75466680) is 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide is CC(NC(=O)c1ccn(-c2ccccc2F)n1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide?
The InChIKey is NOGYINAINWLFTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O3S/c1-12(13-6-8-14(9-7-13)27(20,25)26)21-18(24)16-10-11-23(22-16)17-5-3-2-4-15(17)19/h2-12H,1H3,(H,21,24)(H2,20,25,26).
What are the key properties of 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide?
1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide has a molecular weight of 388.42 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazole-3-carboxamide is sourced from PubChem (CID 75466680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).