2-(fluoromethyl)-N-phenylbenzamide

C14H12FNO — CID 141101349

IUPAC2-(fluoromethyl)-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccccc1CF
InChIInChI=1S/C14H12FNO/c15-10-11-6-4-5-9-13(11)14(17)16-12-7-2-1-3-8-12/h1-9H,10H2,(H,16,17)
InChIKeyDMEQOXUCLCIUAY-UHFFFAOYSA-N
MW229.25 g/mol
LogP3.41
Rot. Bonds3

About 2-(fluoromethyl)-N-phenylbenzamide

2-(fluoromethyl)-N-phenylbenzamide (PubChem CID 141101349) has the molecular formula C14H12FNO and a molecular weight of 229.25 g/mol. Its IUPAC name is 2-(fluoromethyl)-N-phenylbenzamide.

Molecular Properties

Compound Name2-(fluoromethyl)-N-phenylbenzamide
PubChem CID141101349
Molecular FormulaC14H12FNO
Molecular Weight229.25 g/mol
Exact Mass229.09
IUPAC Name2-(fluoromethyl)-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccccc1CF
InChIInChI=1S/C14H12FNO/c15-10-11-6-4-5-9-13(11)14(17)16-12-7-2-1-3-8-12/h1-9H,10H2,(H,16,17)
InChIKeyDMEQOXUCLCIUAY-UHFFFAOYSA-N
XLogP3.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(hydroxymethyl)-N-phenylbenzamide
CID 14198283
2-butyl-N-phenylbenzamide
CID 3695058
2-hydroxy-N-phenylbenzamide
CID 157209959
N-phenyl-2-[[2-(phenylcarbamoyl)phenyl]carbamoylamino]benzamide
CID 139684594
2-hydroxy-N-phenylbenzamide chloride
CID 19021936
2-ethyl-N-(4-methylphenyl)benzamide
CID 20613365
ethane;2-hydroxy-N-phenylbenzamide
CID 54170056
2-(phenylcarbamoyl)benzenecarbothioic S-acid
CID 118007964
2-hydrazinyl-N-phenylbenzamide
CID 12569370
3-(methoxymethyl)-2-methyl-N-phenylbenzamide
CID 151203902
2-(aminomethyl)-N-(4-chlorophenyl)benzamide
CID 82546810
2-(fluoromethyl)benzoyl chloride;dihydrochloride
CID 141117669

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-N-phenylbenzamide?
The IUPAC name of 2-(fluoromethyl)-N-phenylbenzamide (CID 141101349) is 2-(fluoromethyl)-N-phenylbenzamide.
What is the SMILES notation for 2-(fluoromethyl)-N-phenylbenzamide?
The canonical SMILES for 2-(fluoromethyl)-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccccc1CF.
What is the InChIKey of 2-(fluoromethyl)-N-phenylbenzamide?
The InChIKey is DMEQOXUCLCIUAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO/c15-10-11-6-4-5-9-13(11)14(17)16-12-7-2-1-3-8-12/h1-9H,10H2,(H,16,17).
What are the key properties of 2-(fluoromethyl)-N-phenylbenzamide?
2-(fluoromethyl)-N-phenylbenzamide has a molecular weight of 229.25 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-N-phenylbenzamide is sourced from PubChem (CID 141101349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).