4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide

C16H16FNO3 — CID 38800266

IUPAC4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide
SMILESCOc1ccc([C@@H](O)CNC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C16H16FNO3/c1-21-14-8-4-11(5-9-14)15(19)10-18-16(20)12-2-6-13(17)7-3-12/h2-9,15,19H,10H2,1H3,(H,18,20)/t15-/m0/s1
InChIKeyCGUAMIGGSFQPCT-HNNXBMFYSA-N
MW289.31 g/mol
LogP2.30
Rot. Bonds5

About 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide

4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide (PubChem CID 38800266) has the molecular formula C16H16FNO3 and a molecular weight of 289.31 g/mol. Its IUPAC name is 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide
PubChem CID38800266
Molecular FormulaC16H16FNO3
Molecular Weight289.31 g/mol
Exact Mass289.11
IUPAC Name4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide
SMILESCOc1ccc([C@@H](O)CNC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C16H16FNO3/c1-21-14-8-4-11(5-9-14)15(19)10-18-16(20)12-2-6-13(17)7-3-12/h2-9,15,19H,10H2,1H3,(H,18,20)/t15-/m0/s1
InChIKeyCGUAMIGGSFQPCT-HNNXBMFYSA-N
XLogP2.30
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-4-methylbenzamide
CID 110889479
4-[(4-fluorophenyl)sulfamoyl]-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide
CID 55655448
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 47178909
2,2-difluoro-N-[2-(4-fluorophenyl)-2-hydroxyethyl]-2-(4-methoxyphenyl)acetamide
CID 109478476
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-4-pyrazol-1-ylbenzamide
CID 110889458
N-[2-(4-fluorophenyl)-2-hydroxyethyl]-4-(methylsulfanylmethyl)benzamide
CID 110888923
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-4-methoxybenzamide
CID 111566266
4-bromo-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide
CID 55655345
N-[(2S)-2-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-methoxybenzamide
CID 30630679
3-fluoro-N-[2-(4-fluorophenyl)-2-hydroxyethyl]-4-methylbenzamide
CID 110888781
N-[2-hydroxy-2-[4-(trifluoromethyl)phenyl]ethyl]-3,5-dimethoxybenzamide
CID 90534721
N-[2-(4-fluorophenyl)-2-hydroxyethyl]-2-(3-methoxyphenyl)acetamide
CID 110888834

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide?
The IUPAC name of 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide (CID 38800266) is 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide?
The canonical SMILES for 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide is COc1ccc([C@@H](O)CNC(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide?
The InChIKey is CGUAMIGGSFQPCT-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H16FNO3/c1-21-14-8-4-11(5-9-14)15(19)10-18-16(20)12-2-6-13(17)7-3-12/h2-9,15,19H,10H2,1H3,(H,18,20)/t15-/m0/s1.
What are the key properties of 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide?
4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide has a molecular weight of 289.31 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide is sourced from PubChem (CID 38800266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).