N-ethyl-4-fluoro-3-hydroxybenzamide

C9H10FNO2 — CID 130057561

IUPACN-ethyl-4-fluoro-3-hydroxybenzamide
SMILESCCNC(=O)c1ccc(F)c(O)c1
InChIInChI=1S/C9H10FNO2/c1-2-11-9(13)6-3-4-7(10)8(12)5-6/h3-5,12H,2H2,1H3,(H,11,13)
InChIKeyNVPUSUHFCDOGQF-UHFFFAOYSA-N
MW183.18 g/mol
LogP1.28
Rot. Bonds2

About N-ethyl-4-fluoro-3-hydroxybenzamide

N-ethyl-4-fluoro-3-hydroxybenzamide (PubChem CID 130057561) has the molecular formula C9H10FNO2 and a molecular weight of 183.18 g/mol. Its IUPAC name is N-ethyl-4-fluoro-3-hydroxybenzamide.

Molecular Properties

Compound NameN-ethyl-4-fluoro-3-hydroxybenzamide
PubChem CID130057561
Molecular FormulaC9H10FNO2
Molecular Weight183.18 g/mol
Exact Mass183.07
IUPAC NameN-ethyl-4-fluoro-3-hydroxybenzamide
SMILESCCNC(=O)c1ccc(F)c(O)c1
InChIInChI=1S/C9H10FNO2/c1-2-11-9(13)6-3-4-7(10)8(12)5-6/h3-5,12H,2H2,1H3,(H,11,13)
InChIKeyNVPUSUHFCDOGQF-UHFFFAOYSA-N
XLogP1.28
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.18
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-3-hydroxy-N-propylbenzamide
CID 130057564
[4-(ethylcarbamoyl)-2-fluorophenyl]boronic acid
CID 57497293
N-ethyl-3-hydroxy-4-methoxybenzamide
CID 79600193
4-(aminomethyl)-N-ethyl-3-fluorobenzamide;hydrochloride
CID 118377100
N-ethyl-4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
CID 138985706
N-ethyl-5-fluoro-2-hydroxybenzamide
CID 79531934
3-chloro-N-ethyl-4,5-dihydroxybenzamide
CID 144617791
ethane;N-ethyl-4-hydroxybenzamide
CID 144926309
N-ethyl-3-hydroxybenzamide
CID 13175248
4-fluoro-3-hydroxy-N-(pyrimidin-4-ylmethyl)benzamide
CID 77082981
N-[2-(ethylamino)-2-oxoethyl]-3-hydroxy-4-iodobenzamide
CID 113434653
3-(5-chloro-2-fluoro-4-hydroxyphenyl)-N-ethylbenzamide
CID 137334943

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-fluoro-3-hydroxybenzamide?
The IUPAC name of N-ethyl-4-fluoro-3-hydroxybenzamide (CID 130057561) is N-ethyl-4-fluoro-3-hydroxybenzamide.
What is the SMILES notation for N-ethyl-4-fluoro-3-hydroxybenzamide?
The canonical SMILES for N-ethyl-4-fluoro-3-hydroxybenzamide is CCNC(=O)c1ccc(F)c(O)c1.
What is the InChIKey of N-ethyl-4-fluoro-3-hydroxybenzamide?
The InChIKey is NVPUSUHFCDOGQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2/c1-2-11-9(13)6-3-4-7(10)8(12)5-6/h3-5,12H,2H2,1H3,(H,11,13).
What are the key properties of N-ethyl-4-fluoro-3-hydroxybenzamide?
N-ethyl-4-fluoro-3-hydroxybenzamide has a molecular weight of 183.18 g/mol, XLogP of 1.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-fluoro-3-hydroxybenzamide is sourced from PubChem (CID 130057561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).