5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide

C13H11FN2O2 — CID 106936071

IUPAC5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide
SMILESCN(C(=O)c1cc(F)ccc1O)c1ccncc1
InChIInChI=1S/C13H11FN2O2/c1-16(10-4-6-15-7-5-10)13(18)11-8-9(14)2-3-12(11)17/h2-8,17H,1H3
InChIKeyHHLRJOHYSJOJEX-UHFFFAOYSA-N
MW246.24 g/mol
LogP2.20
Rot. Bonds2

About 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide

5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide (PubChem CID 106936071) has the molecular formula C13H11FN2O2 and a molecular weight of 246.24 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide
PubChem CID106936071
Molecular FormulaC13H11FN2O2
Molecular Weight246.24 g/mol
Exact Mass246.08
IUPAC Name5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide
SMILESCN(C(=O)c1cc(F)ccc1O)c1ccncc1
InChIInChI=1S/C13H11FN2O2/c1-16(10-4-6-15-7-5-10)13(18)11-8-9(14)2-3-12(11)17/h2-8,17H,1H3
InChIKeyHHLRJOHYSJOJEX-UHFFFAOYSA-N
XLogP2.20
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.24
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-fluoro-2-hydroxy-N-methyl-N-(4-methylphenyl)benzamide
CID 115299057
4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide
CID 106934866
5-chloro-N-(4-fluorophenyl)-2-hydroxy-N-methylbenzamide
CID 61063244
methyl 2-[4-[(5-fluoro-2-hydroxybenzoyl)-methylamino]phenoxy]acetate
CID 122149828
N-(4-fluorophenyl)-2-hydroxy-N-methyl-5-(propanoylamino)benzamide
CID 75432569
3-chloro-4-hydroxy-N-methyl-N-pyridin-4-ylbenzamide
CID 106936060
2,5-dihydroxy-N-methyl-N-phenylbenzamide
CID 113347039
N-(4-fluorophenyl)-3,4-dihydroxy-N-methylbenzamide
CID 103956579
2,4-diamino-N-methyl-N-pyridin-4-ylbenzamide
CID 106934261
N-(2-bromoethyl)-5-fluoro-2-hydroxy-N-methylbenzamide
CID 115299557
2-bromo-4-fluoro-N-(4-fluorophenyl)-N-methylbenzamide
CID 61063397
2-bromo-4-fluoro-N-(4-hydroxyphenyl)-N-methylbenzamide
CID 28739035

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide (CID 106936071) is 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide is CN(C(=O)c1cc(F)ccc1O)c1ccncc1.
What is the InChIKey of 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide?
The InChIKey is HHLRJOHYSJOJEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O2/c1-16(10-4-6-15-7-5-10)13(18)11-8-9(14)2-3-12(11)17/h2-8,17H,1H3.
What are the key properties of 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide?
5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide has a molecular weight of 246.24 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 106936071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).