N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide

C15H13ClFNO2 — CID 79532591

IUPACN-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide
SMILESCN(Cc1ccccc1Cl)C(=O)c1cc(F)ccc1O
InChIInChI=1S/C15H13ClFNO2/c1-18(9-10-4-2-3-5-13(10)16)15(20)12-8-11(17)6-7-14(12)19/h2-8,19H,9H2,1H3
InChIKeyGQENXJAJKWRUCF-UHFFFAOYSA-N
MW293.73 g/mol
LogP3.46
Rot. Bonds3

About N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide

N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide (PubChem CID 79532591) has the molecular formula C15H13ClFNO2 and a molecular weight of 293.73 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide
PubChem CID79532591
Molecular FormulaC15H13ClFNO2
Molecular Weight293.73 g/mol
Exact Mass293.06
IUPAC NameN-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide
SMILESCN(Cc1ccccc1Cl)C(=O)c1cc(F)ccc1O
InChIInChI=1S/C15H13ClFNO2/c1-18(9-10-4-2-3-5-13(10)16)15(20)12-8-11(17)6-7-14(12)19/h2-8,19H,9H2,1H3
InChIKeyGQENXJAJKWRUCF-UHFFFAOYSA-N
XLogP3.46
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.73
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-2-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 79882419
2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide
CID 106501484
2-(2-chlorophenyl)-1-(5-fluoro-2-hydroxyphenyl)ethanone
CID 2778590
2-chloro-4-fluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 78768857
4-fluoro-2-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 103829572
2-[(2-chlorophenyl)methyl-methylcarbamoyl]benzoic acid
CID 43399794
5-bromo-N-[(2,3-dichlorophenyl)methyl]-2-hydroxy-N-methylbenzamide
CID 35977920
2-chloro-5-fluoro-N-[(2-hydroxyphenyl)methyl]-N-methylpyridine-3-carboxamide
CID 103893263
4-chloro-N-[(2-fluorophenyl)methyl]-2-hydroxy-N-methylbenzamide
CID 60628192
N-(2-bromoethyl)-5-fluoro-2-hydroxy-N-methylbenzamide
CID 115299557
N-[(2-aminophenyl)methyl]-5-fluoro-N,2-dimethylbenzamide
CID 62057041
2-chloro-N-[(2-chlorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 60628317

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide (CID 79532591) is N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide is CN(Cc1ccccc1Cl)C(=O)c1cc(F)ccc1O.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide?
The InChIKey is GQENXJAJKWRUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c1-18(9-10-4-2-3-5-13(10)16)15(20)12-8-11(17)6-7-14(12)19/h2-8,19H,9H2,1H3.
What are the key properties of N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide?
N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide has a molecular weight of 293.73 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide is sourced from PubChem (CID 79532591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).