2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide

C21H19FN2O — CID 42852473

IUPAC2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide
SMILESO=C(Cc1ccc(NCc2ccc(F)cc2)cc1)Nc1ccccc1
InChIInChI=1S/C21H19FN2O/c22-18-10-6-17(7-11-18)15-23-19-12-8-16(9-13-19)14-21(25)24-20-4-2-1-3-5-20/h1-13,23H,14-15H2,(H,24,25)
InChIKeyTYWVXPZJKJOVQP-UHFFFAOYSA-N
MW334.39 g/mol
LogP4.62
Rot. Bonds6

About 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide

2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide (PubChem CID 42852473) has the molecular formula C21H19FN2O and a molecular weight of 334.39 g/mol. Its IUPAC name is 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide
PubChem CID42852473
Molecular FormulaC21H19FN2O
Molecular Weight334.39 g/mol
Exact Mass334.15
IUPAC Name2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide
SMILESO=C(Cc1ccc(NCc2ccc(F)cc2)cc1)Nc1ccccc1
InChIInChI=1S/C21H19FN2O/c22-18-10-6-17(7-11-18)15-23-19-12-8-16(9-13-19)14-21(25)24-20-4-2-1-3-5-20/h1-13,23H,14-15H2,(H,24,25)
InChIKeyTYWVXPZJKJOVQP-UHFFFAOYSA-N
XLogP4.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.39
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(benzylamino)phenyl]-N-[(4-fluorophenyl)methyl]acetamide
CID 42852618
N-benzyl-2-[4-[(4-fluorophenyl)methylamino]phenyl]acetamide
CID 46045383
N-[4-[(4-fluorophenyl)methylamino]phenyl]-2-phenoxyacetamide
CID 112982473
2-(4-fluorophenyl)-N-[4-[(2-methoxyphenyl)methylamino]phenyl]acetamide
CID 112982646
2-phenyl-N-[4-(pyridin-4-ylmethylamino)phenyl]acetamide
CID 112983139
2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide
CID 46045417
2-(2-fluorophenyl)-N-[4-[(4-methylphenyl)methylamino]phenyl]acetamide
CID 112982178
4-fluoro-N-[4-[(4-fluorophenyl)methylamino]phenyl]benzamide
CID 112982456
2-[4-[(3,5-dimethoxyphenyl)methylamino]phenyl]-N-phenylacetamide
CID 42852472
4-fluoro-N-[(4-fluorophenyl)methyl]aniline
CID 1133337
N-(4-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 889367
N-(4-chlorophenyl)-2-(4-fluorophenyl)acetamide
CID 7027780

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide?
The IUPAC name of 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide (CID 42852473) is 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide.
What is the SMILES notation for 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide?
The canonical SMILES for 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide is O=C(Cc1ccc(NCc2ccc(F)cc2)cc1)Nc1ccccc1.
What is the InChIKey of 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide?
The InChIKey is TYWVXPZJKJOVQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O/c22-18-10-6-17(7-11-18)15-23-19-12-8-16(9-13-19)14-21(25)24-20-4-2-1-3-5-20/h1-13,23H,14-15H2,(H,24,25).
What are the key properties of 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide?
2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide has a molecular weight of 334.39 g/mol, XLogP of 4.62, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide is sourced from PubChem (CID 42852473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).