N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide

C20H16FNO2 — CID 2195056

IUPACN-(4-fluorophenyl)-4-(phenoxymethyl)benzamide
SMILESO=C(Nc1ccc(F)cc1)c1ccc(COc2ccccc2)cc1
InChIInChI=1S/C20H16FNO2/c21-17-10-12-18(13-11-17)22-20(23)16-8-6-15(7-9-16)14-24-19-4-2-1-3-5-19/h1-13H,14H2,(H,22,23)
InChIKeyRRWXLRNHKQVOSZ-UHFFFAOYSA-N
MW321.35 g/mol
LogP4.66
Rot. Bonds5

About N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide

N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide (PubChem CID 2195056) has the molecular formula C20H16FNO2 and a molecular weight of 321.35 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-4-(phenoxymethyl)benzamide
PubChem CID2195056
Molecular FormulaC20H16FNO2
Molecular Weight321.35 g/mol
Exact Mass321.12
IUPAC NameN-(4-fluorophenyl)-4-(phenoxymethyl)benzamide
SMILESO=C(Nc1ccc(F)cc1)c1ccc(COc2ccccc2)cc1
InChIInChI=1S/C20H16FNO2/c21-17-10-12-18(13-11-17)22-20(23)16-8-6-15(7-9-16)14-24-19-4-2-1-3-5-19/h1-13H,14H2,(H,22,23)
InChIKeyRRWXLRNHKQVOSZ-UHFFFAOYSA-N
XLogP4.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.35
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide?
The IUPAC name of N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide (CID 2195056) is N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide.
What is the SMILES notation for N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide?
The canonical SMILES for N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide is O=C(Nc1ccc(F)cc1)c1ccc(COc2ccccc2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide?
The InChIKey is RRWXLRNHKQVOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO2/c21-17-10-12-18(13-11-17)22-20(23)16-8-6-15(7-9-16)14-24-19-4-2-1-3-5-19/h1-13H,14H2,(H,22,23).
What are the key properties of N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide?
N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide has a molecular weight of 321.35 g/mol, XLogP of 4.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4-(phenoxymethyl)benzamide is sourced from PubChem (CID 2195056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).