2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide

C18H19FN2O2 — CID 100635454

IUPAC2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccccc1NC(=O)Cc1ccccc1F
InChIInChI=1S/C18H19FN2O2/c1-12(2)20-18(23)14-8-4-6-10-16(14)21-17(22)11-13-7-3-5-9-15(13)19/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyMXTBKFZODNJJSU-UHFFFAOYSA-N
MW314.36 g/mol
LogP3.15
Rot. Bonds5

About 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide

2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide (PubChem CID 100635454) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide
PubChem CID100635454
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC Name2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccccc1NC(=O)Cc1ccccc1F
InChIInChI=1S/C18H19FN2O2/c1-12(2)20-18(23)14-8-4-6-10-16(14)21-17(22)11-13-7-3-5-9-15(13)19/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyMXTBKFZODNJJSU-UHFFFAOYSA-N
XLogP3.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-aminopropanoylamino)-N-propan-2-ylbenzamide
CID 119279299
2-[[2-(2-nitrophenyl)acetyl]amino]-N-propan-2-ylbenzamide
CID 3939264
2-(2-methylpropanoylamino)-N-propan-2-ylbenzamide
CID 34564562
methyl 3-oxo-3-[2-(propan-2-ylcarbamoyl)anilino]propanoate
CID 28638001
4-chloro-3-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide
CID 47049795
N-butan-2-yl-2-[3-(2-fluorophenyl)propanoylamino]benzamide
CID 133251866
2-(2-fluorophenyl)-N-[2-(1-hydroxyethyl)phenyl]acetamide
CID 43508486
2-[[2-(2,5-dimethoxyphenyl)acetyl]amino]-N-propan-2-ylbenzamide
CID 78865415
2-[[2-(2-fluorophenyl)acetyl]amino]-N-(3-methoxyphenyl)benzamide
CID 2516706
N-[2-(1-aminoethyl)phenyl]-2-(2-fluorophenyl)acetamide
CID 16791890
2-[[2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]acetyl]amino]-N-propan-2-ylbenzamide
CID 34556664
N-[(2R)-butan-2-yl]-2-[[2-(2-chlorophenyl)acetyl]amino]benzamide
CID 26706384

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide?
The IUPAC name of 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide (CID 100635454) is 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide.
What is the SMILES notation for 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide?
The canonical SMILES for 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide is CC(C)NC(=O)c1ccccc1NC(=O)Cc1ccccc1F.
What is the InChIKey of 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide?
The InChIKey is MXTBKFZODNJJSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c1-12(2)20-18(23)14-8-4-6-10-16(14)21-17(22)11-13-7-3-5-9-15(13)19/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide?
2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide has a molecular weight of 314.36 g/mol, XLogP of 3.15, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-fluorophenyl)acetyl]amino]-N-propan-2-ylbenzamide is sourced from PubChem (CID 100635454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).