N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide

C11H14FNO3 — CID 82128249

IUPACN-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
SMILESCOc1ccc(F)cc1CN(C)C(=O)CO
InChIInChI=1S/C11H14FNO3/c1-13(11(15)7-14)6-8-5-9(12)3-4-10(8)16-2/h3-5,14H,6-7H2,1-2H3
InChIKeyVONZBVYGYPZXHA-UHFFFAOYSA-N
MW227.23 g/mol
LogP0.79
Rot. Bonds4

About N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide

N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide (PubChem CID 82128249) has the molecular formula C11H14FNO3 and a molecular weight of 227.23 g/mol. Its IUPAC name is N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide.

Molecular Properties

Compound NameN-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
PubChem CID82128249
Molecular FormulaC11H14FNO3
Molecular Weight227.23 g/mol
Exact Mass227.10
IUPAC NameN-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
SMILESCOc1ccc(F)cc1CN(C)C(=O)CO
InChIInChI=1S/C11H14FNO3/c1-13(11(15)7-14)6-8-5-9(12)3-4-10(8)16-2/h3-5,14H,6-7H2,1-2H3
InChIKeyVONZBVYGYPZXHA-UHFFFAOYSA-N
XLogP0.79
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.23
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide 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-amino-N-[(5-fluoro-2-methoxyphenyl)methyl]-N-methylpropanamide
CID 94687738
N-[(5-fluoro-2-methoxyphenyl)methyl]-N-methylcarbamoyl chloride
CID 115194745
N-[(3-fluoro-4-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 82128248
3-(2-chloro-4-fluorophenoxy)-N-[(5-chloro-2-methoxyphenyl)methyl]-N-methylpropanamide
CID 55772529
N-[(2,4-dimethoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 94687468
N-[(2,3-dimethoxyphenyl)methyl]-2-[(5-fluoro-2-methoxyphenyl)methylsulfanyl]-N-methylacetamide
CID 8966714
3-(3-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 78829784
N-[(3,4-dimethoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 14117549
3-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]propanoic acid
CID 60988210
3-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 94870765
N-[(2,5-dimethoxy-3,4-dimethylphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 115140029
2-[(3-fluorophenyl)methyl-methylamino]-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 86908474

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide?
The IUPAC name of N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide (CID 82128249) is N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide.
What is the SMILES notation for N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide?
The canonical SMILES for N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide is COc1ccc(F)cc1CN(C)C(=O)CO.
What is the InChIKey of N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide?
The InChIKey is VONZBVYGYPZXHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO3/c1-13(11(15)7-14)6-8-5-9(12)3-4-10(8)16-2/h3-5,14H,6-7H2,1-2H3.
What are the key properties of N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide?
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide has a molecular weight of 227.23 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide is sourced from PubChem (CID 82128249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).