N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide

C15H14FNO3 — CID 71459065

IUPACN-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide
SMILESCCOc1cccc(NC(=O)c2cc(F)ccc2O)c1
InChIInChI=1S/C15H14FNO3/c1-2-20-12-5-3-4-11(9-12)17-15(19)13-8-10(16)6-7-14(13)18/h3-9,18H,2H2,1H3,(H,17,19)
InChIKeyVGQQPZCFVDGYTI-UHFFFAOYSA-N
MW275.28 g/mol
LogP3.18
Rot. Bonds4

About N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide

N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide (PubChem CID 71459065) has the molecular formula C15H14FNO3 and a molecular weight of 275.28 g/mol. Its IUPAC name is N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide
PubChem CID71459065
Molecular FormulaC15H14FNO3
Molecular Weight275.28 g/mol
Exact Mass275.10
IUPAC NameN-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide
SMILESCCOc1cccc(NC(=O)c2cc(F)ccc2O)c1
InChIInChI=1S/C15H14FNO3/c1-2-20-12-5-3-4-11(9-12)17-15(19)13-8-10(16)6-7-14(13)18/h3-9,18H,2H2,1H3,(H,17,19)
InChIKeyVGQQPZCFVDGYTI-UHFFFAOYSA-N
XLogP3.18
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide
CID 79532343
5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 155535033
4-chloro-N-(3-ethoxyphenyl)-2-fluorobenzamide
CID 47311708
N-(3-ethoxyphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380453
2-[(3-ethoxyphenyl)carbamoyl]benzoic acid
CID 17098079
5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide
CID 115299348
5-fluoro-2-hydroxy-N-(4-propoxyphenyl)benzamide
CID 115299069
N-[3-(bromomethyl)phenyl]-5-fluoro-2-hydroxybenzamide
CID 115299606
N-(3-ethoxyphenyl)-3-hydroxy-4-iodobenzamide
CID 104627784
N-(3-ethoxyphenyl)-2-hydrazinylbenzamide
CID 62247314
2-amino-N-(3-ethoxyphenyl)-3-methylbenzamide
CID 61103168
N-(3-ethynylphenyl)-5-fluoro-2-hydroxybenzamide
CID 79532349

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide?
The IUPAC name of N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide (CID 71459065) is N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide is CCOc1cccc(NC(=O)c2cc(F)ccc2O)c1.
What is the InChIKey of N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide?
The InChIKey is VGQQPZCFVDGYTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3/c1-2-20-12-5-3-4-11(9-12)17-15(19)13-8-10(16)6-7-14(13)18/h3-9,18H,2H2,1H3,(H,17,19).
What are the key properties of N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide?
N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide has a molecular weight of 275.28 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 71459065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).