4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide

C18H13F2NOS — CID 17010893

IUPAC4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide
SMILESO=C(c1ccc(F)cc1)N(Cc1cccs1)c1ccc(F)cc1
InChIInChI=1S/C18H13F2NOS/c19-14-5-3-13(4-6-14)18(22)21(12-17-2-1-11-23-17)16-9-7-15(20)8-10-16/h1-11H,12H2
InChIKeySLHISKRDKRHBTC-UHFFFAOYSA-N
MW329.37 g/mol
LogP4.87
Rot. Bonds4

About 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide

4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 17010893) has the molecular formula C18H13F2NOS and a molecular weight of 329.37 g/mol. Its IUPAC name is 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide
PubChem CID17010893
Molecular FormulaC18H13F2NOS
Molecular Weight329.37 g/mol
Exact Mass329.07
IUPAC Name4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide
SMILESO=C(c1ccc(F)cc1)N(Cc1cccs1)c1ccc(F)cc1
InChIInChI=1S/C18H13F2NOS/c19-14-5-3-13(4-6-14)18(22)21(12-17-2-1-11-23-17)16-9-7-15(20)8-10-16/h1-11H,12H2
InChIKeySLHISKRDKRHBTC-UHFFFAOYSA-N
XLogP4.87
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.37
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide (CID 17010893) is 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide is O=C(c1ccc(F)cc1)N(Cc1cccs1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is SLHISKRDKRHBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F2NOS/c19-14-5-3-13(4-6-14)18(22)21(12-17-2-1-11-23-17)16-9-7-15(20)8-10-16/h1-11H,12H2.
What are the key properties of 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide?
4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 329.37 g/mol, XLogP of 4.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 17010893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).