5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide

C18H15FN2O3S2 — CID 34438299

IUPAC5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide
SMILESCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(-c3ccc(F)cc3)s2)cc1
InChIInChI=1S/C18H15FN2O3S2/c1-26(23,24)21-15-8-6-14(7-9-15)20-18(22)17-11-10-16(25-17)12-2-4-13(19)5-3-12/h2-11,21H,1H3,(H,20,22)
InChIKeyRSTGOIZKEZAMPJ-UHFFFAOYSA-N
MW390.46 g/mol
LogP4.18
Rot. Bonds5

About 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide

5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide (PubChem CID 34438299) has the molecular formula C18H15FN2O3S2 and a molecular weight of 390.46 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide
PubChem CID34438299
Molecular FormulaC18H15FN2O3S2
Molecular Weight390.46 g/mol
Exact Mass390.05
IUPAC Name5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide
SMILESCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(-c3ccc(F)cc3)s2)cc1
InChIInChI=1S/C18H15FN2O3S2/c1-26(23,24)21-15-8-6-14(7-9-15)20-18(22)17-11-10-16(25-17)12-2-4-13(19)5-3-12/h2-11,21H,1H3,(H,20,22)
InChIKeyRSTGOIZKEZAMPJ-UHFFFAOYSA-N
XLogP4.18
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-fluorophenyl)-N-[4-(methylcarbamoylamino)phenyl]thiophene-2-carboxamide
CID 46518220
N-[4-(cyclopropanecarbonylamino)phenyl]-5-(4-fluorophenyl)thiophene-2-carboxamide
CID 18282772
methyl 2-[[2-[4-[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]phenyl]acetyl]amino]acetate
CID 55781537
N-(2-chloro-5-methylsulfonylphenyl)-5-(4-fluorophenyl)thiophene-2-carboxamide
CID 9207037
5-(4-fluorophenyl)-N-propan-2-ylthiophene-2-carboxamide
CID 35807263
N-[3-(dimethylcarbamoyl)phenyl]-5-(4-fluorophenyl)thiophene-2-carboxamide
CID 30378979
5-(4-fluorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]thiophene-2-carboxamide
CID 55567080
N,5-diphenylthiophene-2-carboxamide
CID 3746437
N-[(1S)-1-cyclopropylethyl]-5-(4-fluorophenyl)thiophene-2-carboxamide
CID 30796420
N-[3-(diethylcarbamoyl)phenyl]-5-(4-fluorophenyl)thiophene-2-carboxamide
CID 55368088
5-(4-fluorophenyl)-N'-(2-methylpropanoyl)thiophene-2-carbohydrazide
CID 24554163
N-(4-fluorophenyl)-5-(3-methyl-4-pyridinyl)thiophene-2-carboxamide
CID 166218181

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide (CID 34438299) is 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide is CS(=O)(=O)Nc1ccc(NC(=O)c2ccc(-c3ccc(F)cc3)s2)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide?
The InChIKey is RSTGOIZKEZAMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O3S2/c1-26(23,24)21-15-8-6-14(7-9-15)20-18(22)17-11-10-16(25-17)12-2-4-13(19)5-3-12/h2-11,21H,1H3,(H,20,22).
What are the key properties of 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide?
5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide has a molecular weight of 390.46 g/mol, XLogP of 4.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[4-(methanesulfonamido)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 34438299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).