4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide

C17H17FN2O3 — CID 111566086

IUPAC4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)NCC(O)c2ccccc2F)cc1
InChIInChI=1S/C17H17FN2O3/c1-11(21)20-13-8-6-12(7-9-13)17(23)19-10-16(22)14-4-2-3-5-15(14)18/h2-9,16,22H,10H2,1H3,(H,19,23)(H,20,21)
InChIKeyGVORIUGYBLBEOG-UHFFFAOYSA-N
MW316.33 g/mol
LogP2.25
Rot. Bonds5

About 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide

4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide (PubChem CID 111566086) has the molecular formula C17H17FN2O3 and a molecular weight of 316.33 g/mol. Its IUPAC name is 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide.

Molecular Properties

Compound Name4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
PubChem CID111566086
Molecular FormulaC17H17FN2O3
Molecular Weight316.33 g/mol
Exact Mass316.12
IUPAC Name4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)NCC(O)c2ccccc2F)cc1
InChIInChI=1S/C17H17FN2O3/c1-11(21)20-13-8-6-12(7-9-13)17(23)19-10-16(22)14-4-2-3-5-15(14)18/h2-9,16,22H,10H2,1H3,(H,19,23)(H,20,21)
InChIKeyGVORIUGYBLBEOG-UHFFFAOYSA-N
XLogP2.25
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.33
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[[2-(2-fluorophenyl)-2-hydroxyethyl]carbamoylamino]phenyl]acetamide
CID 51080282
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-4-methoxybenzamide
CID 111566266
4-(ethylsulfanylmethyl)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
CID 111565953
1-[(2S)-2-(2-fluorophenyl)-2-hydroxyethyl]-3-(4-methylphenyl)urea
CID 51939745
1-(4-ethylphenyl)-3-[(2S)-2-(2-fluorophenyl)-2-hydroxyethyl]urea
CID 51944583
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-6-methylsulfanylpyridine-3-carboxamide
CID 111566028
3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
CID 111566265
N-[2-(2-fluorophenyl)-2-hydroxyethyl]thiophene-3-carboxamide
CID 111566262
N'-(4-chlorophenyl)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]oxamide
CID 110893729
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-3-hydroxy-5-methylbenzamide
CID 111578636
4-(cyclopropylmethoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
CID 111565689
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-4-(imidazol-1-ylmethyl)benzamide
CID 111565611

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide?
The IUPAC name of 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide (CID 111566086) is 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide.
What is the SMILES notation for 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide?
The canonical SMILES for 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide is CC(=O)Nc1ccc(C(=O)NCC(O)c2ccccc2F)cc1.
What is the InChIKey of 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide?
The InChIKey is GVORIUGYBLBEOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O3/c1-11(21)20-13-8-6-12(7-9-13)17(23)19-10-16(22)14-4-2-3-5-15(14)18/h2-9,16,22H,10H2,1H3,(H,19,23)(H,20,21).
What are the key properties of 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide?
4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide has a molecular weight of 316.33 g/mol, XLogP of 2.25, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide is sourced from PubChem (CID 111566086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).