N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide

C14H11ClFNO2 — CID 107671680

IUPACN-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)Nc1cc(F)cc(Cl)c1
InChIInChI=1S/C14H11ClFNO2/c1-8-4-12(18)2-3-13(8)14(19)17-11-6-9(15)5-10(16)7-11/h2-7,18H,1H3,(H,17,19)
InChIKeyQYSLVEXHWRUXBJ-UHFFFAOYSA-N
MW279.70 g/mol
LogP3.75
Rot. Bonds2

About N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide

N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide (PubChem CID 107671680) has the molecular formula C14H11ClFNO2 and a molecular weight of 279.70 g/mol. Its IUPAC name is N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide
PubChem CID107671680
Molecular FormulaC14H11ClFNO2
Molecular Weight279.70 g/mol
Exact Mass279.05
IUPAC NameN-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)Nc1cc(F)cc(Cl)c1
InChIInChI=1S/C14H11ClFNO2/c1-8-4-12(18)2-3-13(8)14(19)17-11-6-9(15)5-10(16)7-11/h2-7,18H,1H3,(H,17,19)
InChIKeyQYSLVEXHWRUXBJ-UHFFFAOYSA-N
XLogP3.75
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.70
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-5-fluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 107676875
N-(3-chloro-5-fluorophenyl)-2,5-dihydroxybenzamide
CID 107724034
4-amino-N-(3-chloro-5-fluorophenyl)-3-methylbenzamide
CID 107363413
N-(3-chloro-5-fluorophenyl)-3-hydroxybenzamide
CID 107366818
4-bromo-N-(3-chloro-5-fluorophenyl)-2-fluorobenzamide
CID 103774690
4-hydroxy-N-(4-hydroxy-3-methylphenyl)-2-methylbenzamide
CID 103867304
2-chloro-N-(3-chloro-5-fluorophenyl)-5-sulfanylbenzamide
CID 107370953
3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide
CID 107366859
N-(3,5-dichlorophenyl)-2,5-dihydroxybenzamide
CID 107722277
4-hydroxy-2-methyl-N-(2,4,5-trifluorophenyl)benzamide
CID 103863779
N-(4-carbamothioylphenyl)-4-hydroxy-2-methylbenzamide
CID 107671447
4-hydroxy-2-methyl-N-(4-methylsulfonylphenyl)benzamide
CID 107671551

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide?
The IUPAC name of N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide (CID 107671680) is N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide?
The canonical SMILES for N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide is Cc1cc(O)ccc1C(=O)Nc1cc(F)cc(Cl)c1.
What is the InChIKey of N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide?
The InChIKey is QYSLVEXHWRUXBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO2/c1-8-4-12(18)2-3-13(8)14(19)17-11-6-9(15)5-10(16)7-11/h2-7,18H,1H3,(H,17,19).
What are the key properties of N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide?
N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide has a molecular weight of 279.70 g/mol, XLogP of 3.75, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-5-fluorophenyl)-4-hydroxy-2-methylbenzamide is sourced from PubChem (CID 107671680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).