2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide

C14H22N2O4 — CID 63055739

IUPAC2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide
SMILESCOCCNCc1ccc(OC(C)C(N)=O)c(OC)c1
InChIInChI=1S/C14H22N2O4/c1-10(14(15)17)20-12-5-4-11(8-13(12)19-3)9-16-6-7-18-2/h4-5,8,10,16H,6-7,9H2,1-3H3,(H2,15,17)
InChIKeyUMFRSBQKGXYJGI-UHFFFAOYSA-N
MW282.34 g/mol
LogP0.68
Rot. Bonds9

About 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide

2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide (PubChem CID 63055739) has the molecular formula C14H22N2O4 and a molecular weight of 282.34 g/mol. Its IUPAC name is 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide.

Molecular Properties

Compound Name2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide
PubChem CID63055739
Molecular FormulaC14H22N2O4
Molecular Weight282.34 g/mol
Exact Mass282.16
IUPAC Name2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide
SMILESCOCCNCc1ccc(OC(C)C(N)=O)c(OC)c1
InChIInChI=1S/C14H22N2O4/c1-10(14(15)17)20-12-5-4-11(8-13(12)19-3)9-16-6-7-18-2/h4-5,8,10,16H,6-7,9H2,1-3H3,(H2,15,17)
InChIKeyUMFRSBQKGXYJGI-UHFFFAOYSA-N
XLogP0.68
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide
CID 63057446
2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide
CID 43278556
2-[2-methoxy-4-(propylaminomethyl)phenoxy]butanamide
CID 62899820
3-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]propanamide
CID 63057144
2-[2-methoxy-5-(propylaminomethyl)phenoxy]-N-methylpropanamide
CID 43278792
2-methoxy-N-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl]ethanamine
CID 39366584
methyl 3-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanoate
CID 63950518
2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]propanenitrile
CID 63057613
2-[2-methoxy-5-(propylaminomethyl)phenoxy]-N,N-dimethylpropanamide
CID 43278795
2-methoxy-N-[[4-methoxy-3-(3-methylbut-2-enoxy)phenyl]methyl]ethanamine
CID 63057303
2-methoxy-N-[[4-methoxy-3-(methoxymethoxy)phenyl]methyl]ethanamine
CID 65364721
2-[2-fluoro-4-[(2-methoxyethylamino)methyl]phenoxy]butanamide
CID 107689312

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide?
The IUPAC name of 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide (CID 63055739) is 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide.
What is the SMILES notation for 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide?
The canonical SMILES for 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide is COCCNCc1ccc(OC(C)C(N)=O)c(OC)c1.
What is the InChIKey of 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide?
The InChIKey is UMFRSBQKGXYJGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4/c1-10(14(15)17)20-12-5-4-11(8-13(12)19-3)9-16-6-7-18-2/h4-5,8,10,16H,6-7,9H2,1-3H3,(H2,15,17).
What are the key properties of 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide?
2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide has a molecular weight of 282.34 g/mol, XLogP of 0.68, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide is sourced from PubChem (CID 63055739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).