2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide

C15H12Cl3NO2 — CID 111427451

IUPAC2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide
SMILESO=C(NCC(O)c1cc(Cl)cc(Cl)c1)c1ccccc1Cl
InChIInChI=1S/C15H12Cl3NO2/c16-10-5-9(6-11(17)7-10)14(20)8-19-15(21)12-3-1-2-4-13(12)18/h1-7,14,20H,8H2,(H,19,21)
InChIKeyWSTYWJGKJYVNPG-UHFFFAOYSA-N
MW344.63 g/mol
LogP4.11
Rot. Bonds4

About 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide

2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide (PubChem CID 111427451) has the molecular formula C15H12Cl3NO2 and a molecular weight of 344.63 g/mol. Its IUPAC name is 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide
PubChem CID111427451
Molecular FormulaC15H12Cl3NO2
Molecular Weight344.63 g/mol
Exact Mass342.99
IUPAC Name2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide
SMILESO=C(NCC(O)c1cc(Cl)cc(Cl)c1)c1ccccc1Cl
InChIInChI=1S/C15H12Cl3NO2/c16-10-5-9(6-11(17)7-10)14(20)8-19-15(21)12-3-1-2-4-13(12)18/h1-7,14,20H,8H2,(H,19,21)
InChIKeyWSTYWJGKJYVNPG-UHFFFAOYSA-N
XLogP4.11
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.63
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-(2-hydroxy-2-phenylethyl)-2-methylbenzamide
CID 107097712
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2,4-dichloro-N-[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]benzamide
CID 110280061
4-chloro-2-fluoro-N-[(2S)-2-hydroxy-2-phenylethyl]benzamide
CID 51681217
N-[(2S)-2-(3,5-dichlorophenyl)-2-hydroxyethyl]cyclopropanecarboxamide
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N-[2-(2,6-dichlorophenyl)-2-hydroxyethyl]-2-fluorobenzamide
CID 111452346
3-chloro-N-(2-hydroxy-2-phenylethyl)pyridine-4-carboxamide
CID 66482775
2-amino-4-chloro-N-(2-hydroxy-2-phenylethyl)benzamide
CID 43498535
N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]-3-methoxybenzamide
CID 111427450
2,5-dichloro-N-(2-hydroxy-2-phenylethyl)thiophene-3-carboxamide
CID 103604584
3-amino-2-chloro-N-(2-hydroxy-2-phenylethyl)benzamide
CID 115930153
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CID 7189543

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide?
The IUPAC name of 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide (CID 111427451) is 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide is O=C(NCC(O)c1cc(Cl)cc(Cl)c1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide?
The InChIKey is WSTYWJGKJYVNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl3NO2/c16-10-5-9(6-11(17)7-10)14(20)8-19-15(21)12-3-1-2-4-13(12)18/h1-7,14,20H,8H2,(H,19,21).
What are the key properties of 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide?
2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide has a molecular weight of 344.63 g/mol, XLogP of 4.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]benzamide is sourced from PubChem (CID 111427451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).