4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide

C24H18FNOS — CID 90596881

IUPAC4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
SMILESO=C(NCc1ccccc1-c1ccsc1)c1ccc(-c2ccc(F)cc2)cc1
InChIInChI=1S/C24H18FNOS/c25-22-11-9-18(10-12-22)17-5-7-19(8-6-17)24(27)26-15-20-3-1-2-4-23(20)21-13-14-28-16-21/h1-14,16H,15H2,(H,26,27)
InChIKeyRQFNIGRVRDEAHV-UHFFFAOYSA-N
MW387.48 g/mol
LogP6.15
Rot. Bonds5

About 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide

4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide (PubChem CID 90596881) has the molecular formula C24H18FNOS and a molecular weight of 387.48 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
PubChem CID90596881
Molecular FormulaC24H18FNOS
Molecular Weight387.48 g/mol
Exact Mass387.11
IUPAC Name4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
SMILESO=C(NCc1ccccc1-c1ccsc1)c1ccc(-c2ccc(F)cc2)cc1
InChIInChI=1S/C24H18FNOS/c25-22-11-9-18(10-12-22)17-5-7-19(8-6-17)24(27)26-15-20-3-1-2-4-23(20)21-13-14-28-16-21/h1-14,16H,15H2,(H,26,27)
InChIKeyRQFNIGRVRDEAHV-UHFFFAOYSA-N
XLogP6.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 56.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dimethoxy-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
CID 90596857
4-(diethylsulfamoyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
CID 121145078
2,4,6-trimethyl-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
CID 90596839
2-ethoxy-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
CID 90596843
N-[(2-thiophen-3-ylphenyl)methyl]prop-2-ynamide
CID 90596997
2-thiophen-2-yl-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
CID 71809924
2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
CID 90596848
5-bromo-N-[(2-thiophen-3-ylphenyl)methyl]furan-2-carboxamide
CID 90597008
3-phenyl-N-[(2-thiophen-3-ylphenyl)methyl]propanamide
CID 90596831
1-(2-chlorophenyl)-3-[(2-thiophen-3-ylphenyl)methyl]urea
CID 71809975
N-[(2-thiophen-3-ylphenyl)methyl]undecanamide
CID 90596958
2-[(2-fluorophenyl)sulfonylamino]-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
CID 90596889

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide?
The IUPAC name of 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide (CID 90596881) is 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide.
What is the SMILES notation for 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide?
The canonical SMILES for 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide is O=C(NCc1ccccc1-c1ccsc1)c1ccc(-c2ccc(F)cc2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide?
The InChIKey is RQFNIGRVRDEAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FNOS/c25-22-11-9-18(10-12-22)17-5-7-19(8-6-17)24(27)26-15-20-3-1-2-4-23(20)21-13-14-28-16-21/h1-14,16H,15H2,(H,26,27).
What are the key properties of 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide?
4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide has a molecular weight of 387.48 g/mol, XLogP of 6.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide is sourced from PubChem (CID 90596881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).