3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide

C15H24N2O2 — CID 62326548

IUPAC3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide
SMILESCCNCc1cc(C)c(OCCC(=O)NC)c(C)c1
InChIInChI=1S/C15H24N2O2/c1-5-17-10-13-8-11(2)15(12(3)9-13)19-7-6-14(18)16-4/h8-9,17H,5-7,10H2,1-4H3,(H,16,18)
InChIKeyQWBKYTXNHUVEDY-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.93
Rot. Bonds7

About 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide

3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide (PubChem CID 62326548) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide.

Molecular Properties

Compound Name3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide
PubChem CID62326548
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide
SMILESCCNCc1cc(C)c(OCCC(=O)NC)c(C)c1
InChIInChI=1S/C15H24N2O2/c1-5-17-10-13-8-11(2)15(12(3)9-13)19-7-6-14(18)16-4/h8-9,17H,5-7,10H2,1-4H3,(H,16,18)
InChIKeyQWBKYTXNHUVEDY-UHFFFAOYSA-N
XLogP1.93
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide 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-[[3,5-dimethyl-4-(2-methylsulfonylethoxy)phenyl]methyl]ethanamine
CID 54936905
3-[3-(ethylaminomethyl)phenoxy]-N-methylpropanamide
CID 62324546
2-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]acetamide
CID 43276717
N-tert-butyl-2-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]acetamide
CID 43276736
N-[[3,5-dimethyl-4-(2-propylsulfonylethoxy)phenyl]methyl]ethanamine
CID 106721959
N-[[3,5-dimethyl-4-(2-phenylethoxy)phenyl]methyl]ethanamine
CID 43276733
3-[2,6-dimethoxy-4-(methylaminomethyl)phenoxy]-N-methylpropanamide
CID 62326748
3-[2-bromo-6-methoxy-4-(propylaminomethyl)phenoxy]-N-methylpropanamide
CID 62324369
N-[[3,5-dimethyl-4-(3-methylbut-3-enoxy)phenyl]methyl]propan-1-amine
CID 114471398
2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]-N-methylacetamide
CID 79891352
methyl 3-[4-[(tert-butylamino)methyl]-2,6-dimethylphenoxy]propanoate
CID 63948895
4-[2-bromo-4-(ethylaminomethyl)phenoxy]-N-methylbutanamide
CID 63891379

Frequently Asked Questions

What is the IUPAC name of 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide?
The IUPAC name of 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide (CID 62326548) is 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide.
What is the SMILES notation for 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide?
The canonical SMILES for 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide is CCNCc1cc(C)c(OCCC(=O)NC)c(C)c1.
What is the InChIKey of 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide?
The InChIKey is QWBKYTXNHUVEDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-17-10-13-8-11(2)15(12(3)9-13)19-7-6-14(18)16-4/h8-9,17H,5-7,10H2,1-4H3,(H,16,18).
What are the key properties of 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide?
3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide has a molecular weight of 264.37 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(ethylaminomethyl)-2,6-dimethylphenoxy]-N-methylpropanamide is sourced from PubChem (CID 62326548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).