5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide

C15H15FN2O2 — CID 115299348

IUPAC5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide
SMILESCNCc1cccc(NC(=O)c2cc(F)ccc2O)c1
InChIInChI=1S/C15H15FN2O2/c1-17-9-10-3-2-4-12(7-10)18-15(20)13-8-11(16)5-6-14(13)19/h2-8,17,19H,9H2,1H3,(H,18,20)
InChIKeyLJRZWTSNSHGJAW-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.50
Rot. Bonds4

About 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide

5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide (PubChem CID 115299348) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide
PubChem CID115299348
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide
SMILESCNCc1cccc(NC(=O)c2cc(F)ccc2O)c1
InChIInChI=1S/C15H15FN2O2/c1-17-9-10-3-2-4-12(7-10)18-15(20)13-8-11(16)5-6-14(13)19/h2-8,17,19H,9H2,1H3,(H,18,20)
InChIKeyLJRZWTSNSHGJAW-UHFFFAOYSA-N
XLogP2.50
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-5-iodo-N-[3-(methylaminomethyl)phenyl]benzamide
CID 107732038
N-[3-(bromomethyl)phenyl]-5-fluoro-2-hydroxybenzamide
CID 115299606
3-hydroxy-2-methyl-N-[3-(methylaminomethyl)phenyl]benzamide
CID 82830003
2,6-difluoro-N-[3-(methylaminomethyl)phenyl]benzamide
CID 43601976
N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide
CID 71459065
N-[3-(ethylaminomethyl)phenyl]-2-hydroxy-5-iodobenzamide
CID 107732035
3,4,5-trifluoro-N-[3-(methylaminomethyl)phenyl]benzamide
CID 63186754
3-hydroxy-4-methyl-N-[3-(methylaminomethyl)phenyl]benzamide
CID 43601854
2-(2,5-difluorophenyl)-N-[3-(methylaminomethyl)phenyl]acetamide
CID 84589209
2,3-dichloro-N-[3-(methylaminomethyl)phenyl]benzamide
CID 43601974
5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 155535033
N-(3-ethynylphenyl)-5-fluoro-2-hydroxybenzamide
CID 79532349

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide (CID 115299348) is 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide is CNCc1cccc(NC(=O)c2cc(F)ccc2O)c1.
What is the InChIKey of 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide?
The InChIKey is LJRZWTSNSHGJAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c1-17-9-10-3-2-4-12(7-10)18-15(20)13-8-11(16)5-6-14(13)19/h2-8,17,19H,9H2,1H3,(H,18,20).
What are the key properties of 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide?
5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide has a molecular weight of 274.30 g/mol, XLogP of 2.50, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide is sourced from PubChem (CID 115299348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).