2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide

C12H18N2O3 — CID 107076037

IUPAC2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide
SMILESCCOC(C)CNC(=O)c1cc(O)ccc1N
InChIInChI=1S/C12H18N2O3/c1-3-17-8(2)7-14-12(16)10-6-9(15)4-5-11(10)13/h4-6,8,15H,3,7,13H2,1-2H3,(H,14,16)
InChIKeyDSQKQSKOTCKAHJ-UHFFFAOYSA-N
MW238.29 g/mol
LogP1.13
Rot. Bonds5

About 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide

2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide (PubChem CID 107076037) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide.

Molecular Properties

Compound Name2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide
PubChem CID107076037
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide
SMILESCCOC(C)CNC(=O)c1cc(O)ccc1N
InChIInChI=1S/C12H18N2O3/c1-3-17-8(2)7-14-12(16)10-6-9(15)4-5-11(10)13/h4-6,8,15H,3,7,13H2,1-2H3,(H,14,16)
InChIKeyDSQKQSKOTCKAHJ-UHFFFAOYSA-N
XLogP1.13
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-hydroxy-N-(2-hydroxybutyl)benzamide
CID 107076071
4-amino-N-(2-ethoxypropyl)-6-methylpyridine-3-carboxamide
CID 113478178
N-(2-ethoxypropyl)-4-fluoro-2-hydroxybenzamide
CID 113304594
2-amino-5-hydroxy-N-[2-[methyl(propan-2-yl)amino]ethyl]benzamide
CID 107075161
5-bromo-N-(2-ethoxypropyl)-2-methylbenzamide
CID 115648997
2,5-dihydroxy-N-(2-methoxypropyl)benzamide
CID 107723939
4-bromo-N-(2-ethoxypropyl)-2-methoxybenzamide
CID 115648993
2-amino-N-[2-(dimethylamino)propyl]-5-methylbenzamide
CID 62508707
N-(2-ethoxypropyl)-5-hydrazinyl-2-nitrobenzamide
CID 113478196
2-amino-N-[2-(dimethylamino)propyl]-5-fluorobenzamide
CID 54916025
N-(2-ethoxypropyl)-2-fluoro-4-sulfamoylbenzamide
CID 115883708
N-(2-ethoxypropyl)-3-fluoro-2-(methylamino)benzamide
CID 113478177

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide?
The IUPAC name of 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide (CID 107076037) is 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide.
What is the SMILES notation for 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide?
The canonical SMILES for 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide is CCOC(C)CNC(=O)c1cc(O)ccc1N.
What is the InChIKey of 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide?
The InChIKey is DSQKQSKOTCKAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-3-17-8(2)7-14-12(16)10-6-9(15)4-5-11(10)13/h4-6,8,15H,3,7,13H2,1-2H3,(H,14,16).
What are the key properties of 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide?
2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide has a molecular weight of 238.29 g/mol, XLogP of 1.13, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-ethoxypropyl)-5-hydroxybenzamide is sourced from PubChem (CID 107076037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).