N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide

C16H17NO3 — CID 8638574

IUPACN-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide
SMILESCOCc1ccc(C(=O)Nc2ccc(C)cc2O)cc1
InChIInChI=1S/C16H17NO3/c1-11-3-8-14(15(18)9-11)17-16(19)13-6-4-12(5-7-13)10-20-2/h3-9,18H,10H2,1-2H3,(H,17,19)
InChIKeyHAQTUQZVMACDBI-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.10
Rot. Bonds4

About N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide

N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide (PubChem CID 8638574) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide
PubChem CID8638574
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide
SMILESCOCc1ccc(C(=O)Nc2ccc(C)cc2O)cc1
InChIInChI=1S/C16H17NO3/c1-11-3-8-14(15(18)9-11)17-16(19)13-6-4-12(5-7-13)10-20-2/h3-9,18H,10H2,1-2H3,(H,17,19)
InChIKeyHAQTUQZVMACDBI-UHFFFAOYSA-N
XLogP3.10
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)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-hydroxy-N-(2-hydroxy-4-methylphenyl)benzamide
CID 60654456
N-(2-hydroxy-4-methylphenyl)-4-propan-2-yloxybenzamide
CID 27681755
N-(2-hydroxy-4-methylphenyl)-4-(propanoylamino)benzamide
CID 6458962
N-(2-hydroxy-4-methylphenyl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide
CID 17395323
3,4-diethoxy-N-(2-hydroxy-4-methylphenyl)benzamide
CID 26864885
N-(5-fluoro-2-methylphenyl)-4-(methoxymethyl)benzamide
CID 8572955
N-(2-hydroxy-4-methylphenyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 18138231
methyl N-(2-hydroxy-4-methylphenyl)carbamate
CID 61269197
4-(methoxymethyl)-N-(6-methoxy-2-methyl-3-pyridinyl)benzamide
CID 71919213
N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-3-carboxamide
CID 51331568
3-fluoro-N-(2-hydroxy-4-methylphenyl)-4-methylbenzamide
CID 9087267
N-(2-hydroxy-4-methylphenyl)-2-(2-methoxyethoxy)acetamide
CID 113340015

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide?
The IUPAC name of N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide (CID 8638574) is N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide.
What is the SMILES notation for N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide?
The canonical SMILES for N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide is COCc1ccc(C(=O)Nc2ccc(C)cc2O)cc1.
What is the InChIKey of N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide?
The InChIKey is HAQTUQZVMACDBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-11-3-8-14(15(18)9-11)17-16(19)13-6-4-12(5-7-13)10-20-2/h3-9,18H,10H2,1-2H3,(H,17,19).
What are the key properties of N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide?
N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide has a molecular weight of 271.32 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylphenyl)-4-(methoxymethyl)benzamide is sourced from PubChem (CID 8638574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).