N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide

C16H24N2O4 — CID 50941876

IUPACN-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide
SMILESCOc1cc(OC)c(CN(C)C(C)=O)cc1CN(C)C(C)=O
InChIInChI=1S/C16H24N2O4/c1-11(19)17(3)9-13-7-14(10-18(4)12(2)20)16(22-6)8-15(13)21-5/h7-8H,9-10H2,1-6H3
InChIKeyRJODYHTUXDKJGS-UHFFFAOYSA-N
MW308.38 g/mol
LogP1.66
Rot. Bonds6

About N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide

N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide (PubChem CID 50941876) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide
PubChem CID50941876
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC NameN-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide
SMILESCOc1cc(OC)c(CN(C)C(C)=O)cc1CN(C)C(C)=O
InChIInChI=1S/C16H24N2O4/c1-11(19)17(3)9-13-7-14(10-18(4)12(2)20)16(22-6)8-15(13)21-5/h7-8H,9-10H2,1-6H3
InChIKeyRJODYHTUXDKJGS-UHFFFAOYSA-N
XLogP1.66
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-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

N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N-methylacetamide
CID 115191161
N-[(2,3-dichloro-4-methoxyphenyl)methyl]-N-methylacetamide
CID 115191205
1-[(2-methoxy-4,5-dimethylphenyl)methyl]-1-methylurea
CID 115168360
methyl N-[(5-chloro-2-methoxy-4-methylphenyl)methyl]-N-methylcarbamate
CID 115190631
2-[3-[2-[[acetyl(methyl)amino]methyl]-4-methylphenyl]-4-methoxyphenyl]acetic acid
CID 58149215
N-[2-(2,4-dimethoxyphenyl)ethyl]-N-methylacetamide
CID 115191281
N-[(2-methoxy-4,5-dimethylphenyl)methyl]-N-methyl-3-sulfanylpropanamide
CID 115167934
N-[(5-fluoro-2-methoxyphenyl)methyl]-N-methylcarbamoyl chloride
CID 115194745
(2-methoxy-5-methylphenyl)methyl-methylcarbamic acid
CID 115170937
N-[(2,5-dimethoxyphenyl)methyl]-N-methylcarbamoyl chloride
CID 115194742
2-[methyl-[(2,4,5-trimethoxyphenyl)methyl]amino]ethanol
CID 112683473
N-[(2,5-dimethoxy-4-methylsulfanylphenyl)methyl]-N-methylcarbamoyl bromide
CID 115193852

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide?
The IUPAC name of N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide (CID 50941876) is N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide.
What is the SMILES notation for N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide?
The canonical SMILES for N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide is COc1cc(OC)c(CN(C)C(C)=O)cc1CN(C)C(C)=O.
What is the InChIKey of N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide?
The InChIKey is RJODYHTUXDKJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-11(19)17(3)9-13-7-14(10-18(4)12(2)20)16(22-6)8-15(13)21-5/h7-8H,9-10H2,1-6H3.
What are the key properties of N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide?
N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide has a molecular weight of 308.38 g/mol, XLogP of 1.66, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[acetyl(methyl)amino]methyl]-2,4-dimethoxyphenyl]methyl]-N-methylacetamide is sourced from PubChem (CID 50941876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).