3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide

C15H13ClFNO2 — CID 111566265

IUPAC3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
SMILESO=C(NCC(O)c1ccccc1F)c1cccc(Cl)c1
InChIInChI=1S/C15H13ClFNO2/c16-11-5-3-4-10(8-11)15(20)18-9-14(19)12-6-1-2-7-13(12)17/h1-8,14,19H,9H2,(H,18,20)
InChIKeyIUBIIDKUMQGLLW-UHFFFAOYSA-N
MW293.73 g/mol
LogP2.94
Rot. Bonds4

About 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide

3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide (PubChem CID 111566265) has the molecular formula C15H13ClFNO2 and a molecular weight of 293.73 g/mol. Its IUPAC name is 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
PubChem CID111566265
Molecular FormulaC15H13ClFNO2
Molecular Weight293.73 g/mol
Exact Mass293.06
IUPAC Name3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
SMILESO=C(NCC(O)c1ccccc1F)c1cccc(Cl)c1
InChIInChI=1S/C15H13ClFNO2/c16-11-5-3-4-10(8-11)15(20)18-9-14(19)12-6-1-2-7-13(12)17/h1-8,14,19H,9H2,(H,18,20)
InChIKeyIUBIIDKUMQGLLW-UHFFFAOYSA-N
XLogP2.94
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.73
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-[2-(4-chlorophenyl)-2-hydroxyethyl]benzamide
CID 42947632
N-[2-(2-chlorophenyl)-2-hydroxyethyl]-4-fluoro-3-methylbenzamide
CID 111451028
1-(4-chloro-2-fluorophenyl)-3-[2-(2-fluorophenyl)-2-hydroxyethyl]urea
CID 75876611
3-(3-chlorophenyl)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-methylpropanamide
CID 109478347
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-3-(triazol-1-yl)benzamide
CID 109478348
3-chloro-N-(2-hydroxy-2-thiophen-2-ylethyl)benzamide
CID 71683855
N-[2-(2-fluorophenyl)-2-hydroxyethyl]thiophene-3-carboxamide
CID 111566262
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-3-hydroxy-5-methylbenzamide
CID 111578636
4-acetamido-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
CID 111566086
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-4-methoxybenzamide
CID 111566266
5-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]furan-2-carboxamide
CID 111566061
3,5-dichloro-N-[(2S)-2-hydroxy-2-[2-(trifluoromethyl)phenyl]ethyl]benzamide
CID 52769347

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide?
The IUPAC name of 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide (CID 111566265) is 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide.
What is the SMILES notation for 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide?
The canonical SMILES for 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide is O=C(NCC(O)c1ccccc1F)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide?
The InChIKey is IUBIIDKUMQGLLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c16-11-5-3-4-10(8-11)15(20)18-9-14(19)12-6-1-2-7-13(12)17/h1-8,14,19H,9H2,(H,18,20).
What are the key properties of 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide?
3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide has a molecular weight of 293.73 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide is sourced from PubChem (CID 111566265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).