5-fluoro-2-(3-hydroxypropanoyl)benzamide

C10H10FNO3 — CID 18700444

IUPAC5-fluoro-2-(3-hydroxypropanoyl)benzamide
SMILESNC(=O)c1cc(F)ccc1C(=O)CCO
InChIInChI=1S/C10H10FNO3/c11-6-1-2-7(9(14)3-4-13)8(5-6)10(12)15/h1-2,5,13H,3-4H2,(H2,12,15)
InChIKeyJVWNVFPARTVGMT-UHFFFAOYSA-N
MW211.19 g/mol
LogP0.49
Rot. Bonds4

About 5-fluoro-2-(3-hydroxypropanoyl)benzamide

5-fluoro-2-(3-hydroxypropanoyl)benzamide (PubChem CID 18700444) has the molecular formula C10H10FNO3 and a molecular weight of 211.19 g/mol. Its IUPAC name is 5-fluoro-2-(3-hydroxypropanoyl)benzamide.

Molecular Properties

Compound Name5-fluoro-2-(3-hydroxypropanoyl)benzamide
PubChem CID18700444
Molecular FormulaC10H10FNO3
Molecular Weight211.19 g/mol
Exact Mass211.06
IUPAC Name5-fluoro-2-(3-hydroxypropanoyl)benzamide
SMILESNC(=O)c1cc(F)ccc1C(=O)CCO
InChIInChI=1S/C10H10FNO3/c11-6-1-2-7(9(14)3-4-13)8(5-6)10(12)15/h1-2,5,13H,3-4H2,(H2,12,15)
InChIKeyJVWNVFPARTVGMT-UHFFFAOYSA-N
XLogP0.49
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.19
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-2-(3-hydroxypropyl)benzamide
CID 86681537
1-(2,5-difluorophenyl)-4-hydroxybutan-1-one
CID 70946452
2,4-difluorobenzamide;dihydrochloride
CID 22032026
2-(aminomethyl)-4-fluorobenzamide
CID 174538436
2-(aminomethyl)-5-fluorobenzamide;hydrochloride
CID 173145989
4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide
CID 169453706
2-(azetidine-1-carbonyl)-5-fluorobenzamide
CID 70098132
2-[(2S)-2-amino-3-hydroxypropyl]-5-fluorobenzamide;hydrochloride
CID 70099503
2-ethenyl-4-fluorobenzamide
CID 122232501
2-carbamothioyl-5-fluorobenzoic acid
CID 82670733
4,4,4-trifluoro-1-(4-fluoro-2-methylphenyl)butan-1-one
CID 79954422
4-amino-1-(2-amino-4-fluorophenyl)butan-1-one
CID 105449885

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(3-hydroxypropanoyl)benzamide?
The IUPAC name of 5-fluoro-2-(3-hydroxypropanoyl)benzamide (CID 18700444) is 5-fluoro-2-(3-hydroxypropanoyl)benzamide.
What is the SMILES notation for 5-fluoro-2-(3-hydroxypropanoyl)benzamide?
The canonical SMILES for 5-fluoro-2-(3-hydroxypropanoyl)benzamide is NC(=O)c1cc(F)ccc1C(=O)CCO.
What is the InChIKey of 5-fluoro-2-(3-hydroxypropanoyl)benzamide?
The InChIKey is JVWNVFPARTVGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO3/c11-6-1-2-7(9(14)3-4-13)8(5-6)10(12)15/h1-2,5,13H,3-4H2,(H2,12,15).
What are the key properties of 5-fluoro-2-(3-hydroxypropanoyl)benzamide?
5-fluoro-2-(3-hydroxypropanoyl)benzamide has a molecular weight of 211.19 g/mol, XLogP of 0.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(3-hydroxypropanoyl)benzamide is sourced from PubChem (CID 18700444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).