2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide

C21H18FNO — CID 52571868

IUPAC2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide
SMILESCN(Cc1ccc(-c2ccccc2)cc1)C(=O)c1ccccc1F
InChIInChI=1S/C21H18FNO/c1-23(21(24)19-9-5-6-10-20(19)22)15-16-11-13-18(14-12-16)17-7-3-2-4-8-17/h2-14H,15H2,1H3
InChIKeyNPWSUWMNKSKZEI-UHFFFAOYSA-N
MW319.38 g/mol
LogP4.76
Rot. Bonds4

About 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide

2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide (PubChem CID 52571868) has the molecular formula C21H18FNO and a molecular weight of 319.38 g/mol. Its IUPAC name is 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide
PubChem CID52571868
Molecular FormulaC21H18FNO
Molecular Weight319.38 g/mol
Exact Mass319.14
IUPAC Name2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide
SMILESCN(Cc1ccc(-c2ccccc2)cc1)C(=O)c1ccccc1F
InChIInChI=1S/C21H18FNO/c1-23(21(24)19-9-5-6-10-20(19)22)15-16-11-13-18(14-12-16)17-7-3-2-4-8-17/h2-14H,15H2,1H3
InChIKeyNPWSUWMNKSKZEI-UHFFFAOYSA-N
XLogP4.76
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.38
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide?
The IUPAC name of 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide (CID 52571868) is 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide.
What is the SMILES notation for 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide?
The canonical SMILES for 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide is CN(Cc1ccc(-c2ccccc2)cc1)C(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide?
The InChIKey is NPWSUWMNKSKZEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FNO/c1-23(21(24)19-9-5-6-10-20(19)22)15-16-11-13-18(14-12-16)17-7-3-2-4-8-17/h2-14H,15H2,1H3.
What are the key properties of 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide?
2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide has a molecular weight of 319.38 g/mol, XLogP of 4.76, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methyl-N-[(4-phenylphenyl)methyl]benzamide is sourced from PubChem (CID 52571868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).