3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide

C10H13NO3 — CID 43416195

IUPAC3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NCCO)cc1O
InChIInChI=1S/C10H13NO3/c1-7-2-3-8(6-9(7)13)10(14)11-4-5-12/h2-3,6,12-13H,4-5H2,1H3,(H,11,14)
InChIKeyBFZLJQNXXZZNFR-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.42
Rot. Bonds3

About 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide

3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide (PubChem CID 43416195) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide.

Molecular Properties

Compound Name3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide
PubChem CID43416195
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NCCO)cc1O
InChIInChI=1S/C10H13NO3/c1-7-2-3-8(6-9(7)13)10(14)11-4-5-12/h2-3,6,12-13H,4-5H2,1H3,(H,11,14)
InChIKeyBFZLJQNXXZZNFR-UHFFFAOYSA-N
XLogP0.42
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide 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

3-hydroxy-4-methyl-N-[2-(propan-2-ylamino)ethyl]benzamide
CID 62664549
3-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methylbenzamide
CID 61017535
N-but-2-ynyl-3-hydroxy-4-methylbenzamide
CID 115993868
3-hydroxy-4-methyl-N-(3-sulfamoylpropyl)benzamide
CID 61132238
N-(2-cyclopentylethyl)-3-hydroxy-4-methylbenzamide
CID 54932367
3-hydroxy-4-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 54940691
3-hydroxy-N-(2-hydroxy-3-methylbutyl)-4-methylbenzamide
CID 110014999
3-hydroxy-N-[(2R)-1-hydroxypropan-2-yl]-4-methylbenzamide
CID 79030846
3-hydroxy-N-(2-hydroxy-3,3-dimethylbutyl)-4-methylbenzamide
CID 110016294
N-(3-bromo-2,2-dimethylpropyl)-3-hydroxy-4-methylbenzamide
CID 115364936
3-hydroxy-N-[[1-(hydroxymethyl)cyclohexyl]methyl]-4-methylbenzamide
CID 115993853
3-hydroxy-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-methylbenzamide
CID 62849743

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide?
The IUPAC name of 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide (CID 43416195) is 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide.
What is the SMILES notation for 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide?
The canonical SMILES for 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide is Cc1ccc(C(=O)NCCO)cc1O.
What is the InChIKey of 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide?
The InChIKey is BFZLJQNXXZZNFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-7-2-3-8(6-9(7)13)10(14)11-4-5-12/h2-3,6,12-13H,4-5H2,1H3,(H,11,14).
What are the key properties of 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide?
3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide has a molecular weight of 195.22 g/mol, XLogP of 0.42, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-hydroxyethyl)-4-methylbenzamide is sourced from PubChem (CID 43416195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).