N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide

C18H14FNOS — CID 46565128

IUPACN-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide
SMILESO=C(NC(c1ccc(F)cc1)c1cccs1)c1ccccc1
InChIInChI=1S/C18H14FNOS/c19-15-10-8-13(9-11-15)17(16-7-4-12-22-16)20-18(21)14-5-2-1-3-6-14/h1-12,17H,(H,20,21)
InChIKeyFVIXREUKFBPRJB-UHFFFAOYSA-N
MW311.38 g/mol
LogP4.41
Rot. Bonds4

About N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide

N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide (PubChem CID 46565128) has the molecular formula C18H14FNOS and a molecular weight of 311.38 g/mol. Its IUPAC name is N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide
PubChem CID46565128
Molecular FormulaC18H14FNOS
Molecular Weight311.38 g/mol
Exact Mass311.08
IUPAC NameN-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide
SMILESO=C(NC(c1ccc(F)cc1)c1cccs1)c1ccccc1
InChIInChI=1S/C18H14FNOS/c19-15-10-8-13(9-11-15)17(16-7-4-12-22-16)20-18(21)14-5-2-1-3-6-14/h1-12,17H,(H,20,21)
InChIKeyFVIXREUKFBPRJB-UHFFFAOYSA-N
XLogP4.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide?
The IUPAC name of N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide (CID 46565128) is N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide.
What is the SMILES notation for N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide?
The canonical SMILES for N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide is O=C(NC(c1ccc(F)cc1)c1cccs1)c1ccccc1.
What is the InChIKey of N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide?
The InChIKey is FVIXREUKFBPRJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FNOS/c19-15-10-8-13(9-11-15)17(16-7-4-12-22-16)20-18(21)14-5-2-1-3-6-14/h1-12,17H,(H,20,21).
What are the key properties of N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide?
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide has a molecular weight of 311.38 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide is sourced from PubChem (CID 46565128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).