N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide

C19H14F3NO2S — CID 6094043

IUPACN-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3ccccc3C(F)(F)F)s2)cc1
InChIInChI=1S/C19H14F3NO2S/c1-25-13-8-6-12(7-9-13)23-18(24)17-11-10-16(26-17)14-4-2-3-5-15(14)19(20,21)22/h2-11H,1H3,(H,23,24)
InChIKeyNCHNHLPTGVMBFF-UHFFFAOYSA-N
MW377.39 g/mol
LogP5.69
Rot. Bonds4

About N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide

N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide (PubChem CID 6094043) has the molecular formula C19H14F3NO2S and a molecular weight of 377.39 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide
PubChem CID6094043
Molecular FormulaC19H14F3NO2S
Molecular Weight377.39 g/mol
Exact Mass377.07
IUPAC NameN-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3ccccc3C(F)(F)F)s2)cc1
InChIInChI=1S/C19H14F3NO2S/c1-25-13-8-6-12(7-9-13)23-18(24)17-11-10-16(26-17)14-4-2-3-5-15(14)19(20,21)22/h2-11H,1H3,(H,23,24)
InChIKeyNCHNHLPTGVMBFF-UHFFFAOYSA-N
XLogP5.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.39
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-tert-butyl-N-(4-methoxyphenyl)thiophene-2-carboxamide
CID 2741497
2-(4-methoxyanilino)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 109009101
methyl 2-[2-(5-acetylthiophen-2-yl)phenyl]-2-methylpropanoate
CID 135337035
methyl 5-[(4-phenoxyphenyl)carbamoyl]thiophene-2-carboxylate
CID 38764463
methyl 3-amino-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxylate
CID 43155499
N-(4-methoxyphenyl)-1-oxoisothiochromene-3-carboxamide
CID 17015253
N-(4-methoxyphenyl)-4-[[2-[2-(trifluoromethyl)phenyl]cyclopropanecarbonyl]amino]benzamide
CID 134055578
N-(4-methoxyphenyl)-4H-thieno[3,2-c]thiochromene-2-carboxamide
CID 6623288
4-methoxy-N-[4-methyl-3-(trifluoromethyl)phenyl]benzamide
CID 52545008
N,5-diphenylthiophene-2-carboxamide
CID 3746437
N-(4-methoxyphenyl)-5,5-dioxo-4H-thieno[3,2-c]thiochromene-2-carboxamide
CID 23602484
5-(3-aminoprop-1-ynyl)-N-(4-methoxyphenyl)thiophene-2-carboxamide
CID 61075838

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide (CID 6094043) is N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide is COc1ccc(NC(=O)c2ccc(-c3ccccc3C(F)(F)F)s2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide?
The InChIKey is NCHNHLPTGVMBFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3NO2S/c1-25-13-8-6-12(7-9-13)23-18(24)17-11-10-16(26-17)14-4-2-3-5-15(14)19(20,21)22/h2-11H,1H3,(H,23,24).
What are the key properties of N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide?
N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide has a molecular weight of 377.39 g/mol, XLogP of 5.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-5-[2-(trifluoromethyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 6094043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).