3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide

C9H10FNO4 — CID 171867767

IUPAC3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide
SMILESNC(=O)C(O)C(O)c1ccc(F)cc1O
InChIInChI=1S/C9H10FNO4/c10-4-1-2-5(6(12)3-4)7(13)8(14)9(11)15/h1-3,7-8,12-14H,(H2,11,15)
InChIKeyHHUFKNAQXGKHBT-UHFFFAOYSA-N
MW215.18 g/mol
LogP-0.59
Rot. Bonds3

About 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide

3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide (PubChem CID 171867767) has the molecular formula C9H10FNO4 and a molecular weight of 215.18 g/mol. Its IUPAC name is 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide.

Molecular Properties

Compound Name3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide
PubChem CID171867767
Molecular FormulaC9H10FNO4
Molecular Weight215.18 g/mol
Exact Mass215.06
IUPAC Name3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide
SMILESNC(=O)C(O)C(O)c1ccc(F)cc1O
InChIInChI=1S/C9H10FNO4/c10-4-1-2-5(6(12)3-4)7(13)8(14)9(11)15/h1-3,7-8,12-14H,(H2,11,15)
InChIKeyHHUFKNAQXGKHBT-UHFFFAOYSA-N
XLogP-0.59
TPSA103.78 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.18
LogP ≤ 5-0.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-amino-5-fluorophenyl)-2,3-dihydroxypropanamide
CID 171867868
2,3-dihydroxy-3-(2-hydroxy-4-methoxyphenyl)propanamide
CID 171868027
3-[4-(diethylamino)-2-hydroxyphenyl]-2,3-dihydroxypropanamide
CID 171869443
2-(4-fluoro-2-hydroxyphenyl)-2-hydroxyacetic acid
CID 117280331
3-(2-ethoxy-5-fluorophenyl)-2,3-dihydroxypropanamide
CID 171868483
3-(3-amino-1,2-dihydroxy-3-oxopropyl)-4-hydroxybenzoic acid
CID 171868523
3-(5-chloro-2-hydroxyphenyl)-2,3-dihydroxypropanamide
CID 171867764
methyl 2-(4-fluoro-2-hydroxyphenyl)propanoate
CID 57447177
2-[(2-amino-2-oxoethyl)-[1-(4-fluoro-2-hydroxyphenyl)ethyl]amino]acetamide
CID 82979371
2-[1-(4-fluoro-2-hydroxyphenyl)ethyl-methylamino]acetamide
CID 82977734
3-(5-fluoro-2-hydroxy-3-nitrophenyl)-2,3-dihydroxypropanamide
CID 171868869
3-(2,4-difluoro-3-formylphenyl)-2,3-dihydroxypropanamide
CID 171868515

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide?
The IUPAC name of 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide (CID 171867767) is 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide.
What is the SMILES notation for 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide?
The canonical SMILES for 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide is NC(=O)C(O)C(O)c1ccc(F)cc1O.
What is the InChIKey of 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide?
The InChIKey is HHUFKNAQXGKHBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO4/c10-4-1-2-5(6(12)3-4)7(13)8(14)9(11)15/h1-3,7-8,12-14H,(H2,11,15).
What are the key properties of 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide?
3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide has a molecular weight of 215.18 g/mol, XLogP of -0.59, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoro-2-hydroxyphenyl)-2,3-dihydroxypropanamide is sourced from PubChem (CID 171867767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).