2,4-diethyl-N,6-dihydroxybenzamide

C11H15NO3 — CID 45094929

IUPAC2,4-diethyl-N,6-dihydroxybenzamide
SMILESCCc1cc(O)c(C(=O)NO)c(CC)c1
InChIInChI=1S/C11H15NO3/c1-3-7-5-8(4-2)10(9(13)6-7)11(14)12-15/h5-6,13,15H,3-4H2,1-2H3,(H,12,14)
InChIKeyGAEYIRYMIPJCOR-UHFFFAOYSA-N
MW209.24 g/mol
LogP1.64
Rot. Bonds3

About 2,4-diethyl-N,6-dihydroxybenzamide

2,4-diethyl-N,6-dihydroxybenzamide (PubChem CID 45094929) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 2,4-diethyl-N,6-dihydroxybenzamide.

Molecular Properties

Compound Name2,4-diethyl-N,6-dihydroxybenzamide
PubChem CID45094929
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name2,4-diethyl-N,6-dihydroxybenzamide
SMILESCCc1cc(O)c(C(=O)NO)c(CC)c1
InChIInChI=1S/C11H15NO3/c1-3-7-5-8(4-2)10(9(13)6-7)11(14)12-15/h5-6,13,15H,3-4H2,1-2H3,(H,12,14)
InChIKeyGAEYIRYMIPJCOR-UHFFFAOYSA-N
XLogP1.64
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,4-diethyl-N,6-dihydroxybenzamide?
The IUPAC name of 2,4-diethyl-N,6-dihydroxybenzamide (CID 45094929) is 2,4-diethyl-N,6-dihydroxybenzamide.
What is the SMILES notation for 2,4-diethyl-N,6-dihydroxybenzamide?
The canonical SMILES for 2,4-diethyl-N,6-dihydroxybenzamide is CCc1cc(O)c(C(=O)NO)c(CC)c1.
What is the InChIKey of 2,4-diethyl-N,6-dihydroxybenzamide?
The InChIKey is GAEYIRYMIPJCOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-3-7-5-8(4-2)10(9(13)6-7)11(14)12-15/h5-6,13,15H,3-4H2,1-2H3,(H,12,14).
What are the key properties of 2,4-diethyl-N,6-dihydroxybenzamide?
2,4-diethyl-N,6-dihydroxybenzamide has a molecular weight of 209.24 g/mol, XLogP of 1.64, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diethyl-N,6-dihydroxybenzamide is sourced from PubChem (CID 45094929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).