4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide

C17H20N2O2 — CID 107073824

IUPAC4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccc(N)c(O)c1
InChIInChI=1S/C17H20N2O2/c1-3-11-6-5-7-12(4-2)16(11)19-17(21)13-8-9-14(18)15(20)10-13/h5-10,20H,3-4,18H2,1-2H3,(H,19,21)
InChIKeyRLDIQQFFZLCBSQ-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.35
Rot. Bonds4

About 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide

4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide (PubChem CID 107073824) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide.

Molecular Properties

Compound Name4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide
PubChem CID107073824
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccc(N)c(O)c1
InChIInChI=1S/C17H20N2O2/c1-3-11-6-5-7-12(4-2)16(11)19-17(21)13-8-9-14(18)15(20)10-13/h5-10,20H,3-4,18H2,1-2H3,(H,19,21)
InChIKeyRLDIQQFFZLCBSQ-UHFFFAOYSA-N
XLogP3.35
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-diethylphenyl)-4-hydroxy-3-methylbenzamide
CID 103956619
N-(2-ethyl-6-methylphenyl)-3,4-dihydroxybenzamide
CID 113199272
4-amino-3-hydroxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 107073896
3-amino-4-bromo-N-(2-ethyl-6-methylphenyl)benzamide
CID 61090453
2-amino-6-chloro-N-(2,6-diethylphenyl)pyridine-4-carboxamide
CID 62153038
N-(2,6-diethylphenyl)-2-oxo-1H-pyridine-4-carboxamide
CID 110600773
N-(2,6-diethylphenyl)-3-nitrobenzamide
CID 731505
1-N-(2,6-diethylphenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043170
4-amino-N-(2,6-dichloro-4-fluorophenyl)-3-hydroxybenzamide
CID 107075861
4-cyano-N-(2,6-diethylphenyl)benzamide
CID 2592061
3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide
CID 61091035
4-amino-3-hydroxy-N-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 102739312

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide?
The IUPAC name of 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide (CID 107073824) is 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide.
What is the SMILES notation for 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide?
The canonical SMILES for 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide is CCc1cccc(CC)c1NC(=O)c1ccc(N)c(O)c1.
What is the InChIKey of 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide?
The InChIKey is RLDIQQFFZLCBSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-11-6-5-7-12(4-2)16(11)19-17(21)13-8-9-14(18)15(20)10-13/h5-10,20H,3-4,18H2,1-2H3,(H,19,21).
What are the key properties of 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide?
4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide has a molecular weight of 284.36 g/mol, XLogP of 3.35, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide is sourced from PubChem (CID 107073824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).