2,5-dihydroxy-N-(2-methoxypropyl)benzamide

C11H15NO4 — CID 107723939

IUPAC2,5-dihydroxy-N-(2-methoxypropyl)benzamide
SMILESCOC(C)CNC(=O)c1cc(O)ccc1O
InChIInChI=1S/C11H15NO4/c1-7(16-2)6-12-11(15)9-5-8(13)3-4-10(9)14/h3-5,7,13-14H,6H2,1-2H3,(H,12,15)
InChIKeyBJALCFLTVWQNQH-UHFFFAOYSA-N
MW225.24 g/mol
LogP0.86
Rot. Bonds4

About 2,5-dihydroxy-N-(2-methoxypropyl)benzamide

2,5-dihydroxy-N-(2-methoxypropyl)benzamide (PubChem CID 107723939) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 2,5-dihydroxy-N-(2-methoxypropyl)benzamide.

Molecular Properties

Compound Name2,5-dihydroxy-N-(2-methoxypropyl)benzamide
PubChem CID107723939
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name2,5-dihydroxy-N-(2-methoxypropyl)benzamide
SMILESCOC(C)CNC(=O)c1cc(O)ccc1O
InChIInChI=1S/C11H15NO4/c1-7(16-2)6-12-11(15)9-5-8(13)3-4-10(9)14/h3-5,7,13-14H,6H2,1-2H3,(H,12,15)
InChIKeyBJALCFLTVWQNQH-UHFFFAOYSA-N
XLogP0.86
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2,5-dihydroxy-N-(2-methoxypropyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-fluoro-2-hydroxy-N-(2-methoxypropyl)benzamide
CID 102737733
N-(4-chloro-2-methylbutyl)-2,5-dihydroxybenzamide
CID 107725987
3-[(2,5-dihydroxybenzoyl)amino]-2-hydroxypropanoic acid
CID 107721718
2,5-dihydroxy-N-(3-methyl-2-oxobutyl)benzamide
CID 107722175
N-(cyanomethyl)-2,5-dihydroxybenzamide
CID 103892329
N-(2-cyanopropyl)-2-hydroxy-5-methoxybenzamide
CID 55102191
2,5-dichloro-N-(2-methoxypropyl)benzamide
CID 101005301
N-(2,2-dicyclopropylethyl)-2,5-dihydroxybenzamide
CID 107723246
methyl 4-[(2,5-dihydroxybenzoyl)amino]butanoate
CID 67654054
(2S)-2-hydroxy-3-[(2-hydroxy-5-methoxybenzoyl)amino]propanoic acid
CID 107833807
5-bromo-N-(2,2-dimethoxyethyl)-2-hydroxybenzamide
CID 103602044
methyl 3-[(2,5-dihydroxybenzoyl)amino]butanoate
CID 113347091

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydroxy-N-(2-methoxypropyl)benzamide?
The IUPAC name of 2,5-dihydroxy-N-(2-methoxypropyl)benzamide (CID 107723939) is 2,5-dihydroxy-N-(2-methoxypropyl)benzamide.
What is the SMILES notation for 2,5-dihydroxy-N-(2-methoxypropyl)benzamide?
The canonical SMILES for 2,5-dihydroxy-N-(2-methoxypropyl)benzamide is COC(C)CNC(=O)c1cc(O)ccc1O.
What is the InChIKey of 2,5-dihydroxy-N-(2-methoxypropyl)benzamide?
The InChIKey is BJALCFLTVWQNQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-7(16-2)6-12-11(15)9-5-8(13)3-4-10(9)14/h3-5,7,13-14H,6H2,1-2H3,(H,12,15).
What are the key properties of 2,5-dihydroxy-N-(2-methoxypropyl)benzamide?
2,5-dihydroxy-N-(2-methoxypropyl)benzamide has a molecular weight of 225.24 g/mol, XLogP of 0.86, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydroxy-N-(2-methoxypropyl)benzamide is sourced from PubChem (CID 107723939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).