2,6-dihydroxy-N-(2-oxopropyl)benzamide

C10H11NO4 — CID 107688759

IUPAC2,6-dihydroxy-N-(2-oxopropyl)benzamide
SMILESCC(=O)CNC(=O)c1c(O)cccc1O
InChIInChI=1S/C10H11NO4/c1-6(12)5-11-10(15)9-7(13)3-2-4-8(9)14/h2-4,13-14H,5H2,1H3,(H,11,15)
InChIKeyFBOFWPIQKNBQGK-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.42
Rot. Bonds3

About 2,6-dihydroxy-N-(2-oxopropyl)benzamide

2,6-dihydroxy-N-(2-oxopropyl)benzamide (PubChem CID 107688759) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is 2,6-dihydroxy-N-(2-oxopropyl)benzamide.

Molecular Properties

Compound Name2,6-dihydroxy-N-(2-oxopropyl)benzamide
PubChem CID107688759
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name2,6-dihydroxy-N-(2-oxopropyl)benzamide
SMILESCC(=O)CNC(=O)c1c(O)cccc1O
InChIInChI=1S/C10H11NO4/c1-6(12)5-11-10(15)9-7(13)3-2-4-8(9)14/h2-4,13-14H,5H2,1H3,(H,11,15)
InChIKeyFBOFWPIQKNBQGK-UHFFFAOYSA-N
XLogP0.42
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(2,6-dihydroxybenzoyl)amino]acetate
CID 103890198
2,6-dihydroxy-N-(2-methoxyethyl)benzamide
CID 103748859
2,6-dihydroxy-N-(2-methylsulfanylethyl)benzamide
CID 103890422
N-(2-ethylbutyl)-2,6-dihydroxybenzamide
CID 103890450
N'-acetyl-2,6-dihydroxybenzohydrazide
CID 139076787
2,6-dihydroxy-N-[2-(propan-2-ylamino)ethyl]benzamide
CID 107690240
2,6-dihydroxy-N-(3-hydroxybutyl)benzamide
CID 103890654
2,6-dihydroxy-N-[3-(methylamino)-3-oxopropyl]benzamide
CID 103890327
N-(3,3-dimethyl-2-oxobutyl)-2-fluoro-6-hydroxybenzamide
CID 104920518
2-fluoro-6-hydroxy-N-(3-methyl-2-oxobutyl)benzamide
CID 104920523
N-(2-oxopropyl)-4-[4-(2-oxopropylcarbamoyl)phenyl]benzamide
CID 70857142
N-(2-amino-2-oxoethyl)-2-fluoro-6-hydroxybenzamide
CID 104917526

Frequently Asked Questions

What is the IUPAC name of 2,6-dihydroxy-N-(2-oxopropyl)benzamide?
The IUPAC name of 2,6-dihydroxy-N-(2-oxopropyl)benzamide (CID 107688759) is 2,6-dihydroxy-N-(2-oxopropyl)benzamide.
What is the SMILES notation for 2,6-dihydroxy-N-(2-oxopropyl)benzamide?
The canonical SMILES for 2,6-dihydroxy-N-(2-oxopropyl)benzamide is CC(=O)CNC(=O)c1c(O)cccc1O.
What is the InChIKey of 2,6-dihydroxy-N-(2-oxopropyl)benzamide?
The InChIKey is FBOFWPIQKNBQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-6(12)5-11-10(15)9-7(13)3-2-4-8(9)14/h2-4,13-14H,5H2,1H3,(H,11,15).
What are the key properties of 2,6-dihydroxy-N-(2-oxopropyl)benzamide?
2,6-dihydroxy-N-(2-oxopropyl)benzamide has a molecular weight of 209.20 g/mol, XLogP of 0.42, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dihydroxy-N-(2-oxopropyl)benzamide is sourced from PubChem (CID 107688759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).