2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide

C21H16FNO2 — CID 9142222

IUPAC2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide
SMILESO=C(NCc1ccccc1F)c1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C21H16FNO2/c22-19-13-7-4-10-16(19)14-23-21(25)18-12-6-5-11-17(18)20(24)15-8-2-1-3-9-15/h1-13H,14H2,(H,23,25)
InChIKeyQPKJSLIZNBBOIA-UHFFFAOYSA-N
MW333.36 g/mol
LogP3.99
Rot. Bonds5

About 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide

2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide (PubChem CID 9142222) has the molecular formula C21H16FNO2 and a molecular weight of 333.36 g/mol. Its IUPAC name is 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide.

Molecular Properties

Compound Name2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide
PubChem CID9142222
Molecular FormulaC21H16FNO2
Molecular Weight333.36 g/mol
Exact Mass333.12
IUPAC Name2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide
SMILESO=C(NCc1ccccc1F)c1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C21H16FNO2/c22-19-13-7-4-10-16(19)14-23-21(25)18-12-6-5-11-17(18)20(24)15-8-2-1-3-9-15/h1-13H,14H2,(H,23,25)
InChIKeyQPKJSLIZNBBOIA-UHFFFAOYSA-N
XLogP3.99
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.36
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-fluorophenyl)methylcarbamoyl]benzoic acid
CID 43397101
2-benzoyl-N-[(2-hydroxyphenyl)methyl]benzamide
CID 71881144
2-chloro-N-[(2-fluorophenyl)methyl]benzamide
CID 5082380
2-[2-[(2-fluorophenyl)methylcarbamoyl]phenyl]benzoate
CID 7407568
2,3,4-trifluoro-N-[(2-fluorophenyl)methyl]benzamide
CID 110755457
3-fluoro-N-[(2-fluorophenyl)methyl]-2-hydrazinylbenzamide
CID 62660803
N-[(2-fluorophenyl)methyl]-2-nitrobenzamide
CID 7924688
N-[(2-bromophenyl)methyl]-2-fluorobenzamide
CID 17173440
2-fluoro-N-[(2-fluorophenyl)methyl]-5-methylbenzamide
CID 62510380
N-[(2-fluorophenyl)methyl]-2-hydrazinylpyridine-3-carboxamide
CID 62247960
3-butyl-2-fluoro-N-[(2-fluorophenyl)methyl]benzamide
CID 175327917
3-(benzamidomethyl)-2-fluorobenzoic acid
CID 175493024

Frequently Asked Questions

What is the IUPAC name of 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide?
The IUPAC name of 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide (CID 9142222) is 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide.
What is the SMILES notation for 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide?
The canonical SMILES for 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide is O=C(NCc1ccccc1F)c1ccccc1C(=O)c1ccccc1.
What is the InChIKey of 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide?
The InChIKey is QPKJSLIZNBBOIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FNO2/c22-19-13-7-4-10-16(19)14-23-21(25)18-12-6-5-11-17(18)20(24)15-8-2-1-3-9-15/h1-13H,14H2,(H,23,25).
What are the key properties of 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide?
2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide has a molecular weight of 333.36 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzoyl-N-[(2-fluorophenyl)methyl]benzamide is sourced from PubChem (CID 9142222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).