2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide

C15H24N2O4 — CID 63057446

IUPAC2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide
SMILESCNC(=O)C(C)Oc1cc(CNCCOC)ccc1OC
InChIInChI=1S/C15H24N2O4/c1-11(15(18)16-2)21-14-9-12(5-6-13(14)20-4)10-17-7-8-19-3/h5-6,9,11,17H,7-8,10H2,1-4H3,(H,16,18)
InChIKeyKOAHGPWVSFJLJS-UHFFFAOYSA-N
MW296.37 g/mol
LogP0.94
Rot. Bonds9

About 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide

2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide (PubChem CID 63057446) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide.

Molecular Properties

Compound Name2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide
PubChem CID63057446
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide
SMILESCNC(=O)C(C)Oc1cc(CNCCOC)ccc1OC
InChIInChI=1S/C15H24N2O4/c1-11(15(18)16-2)21-14-9-12(5-6-13(14)20-4)10-17-7-8-19-3/h5-6,9,11,17H,7-8,10H2,1-4H3,(H,16,18)
InChIKeyKOAHGPWVSFJLJS-UHFFFAOYSA-N
XLogP0.94
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 50.94
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-(propylaminomethyl)phenoxy]-N-methylpropanamide
CID 43278792
2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide
CID 63055739
2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]propanenitrile
CID 63057613
2-[2-ethoxy-4-(propylaminomethyl)phenoxy]-N-methylpropanamide
CID 43278181
2-[4-[(tert-butylamino)methyl]-2-methoxyphenoxy]-N-methylpropanamide
CID 63057094
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
3-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]propanamide
CID 63057144
2-[2-methoxy-5-(propylaminomethyl)phenoxy]-N,N-dimethylpropanamide
CID 43278795
2-[5-(aminomethyl)-2-methoxyphenoxy]-N-(methylcarbamoyl)propanamide
CID 43122504
2-(5-formyl-2-methoxyphenoxy)-N-methylpropanamide
CID 43085566
2-methoxy-N-[[4-methoxy-3-(3-methylbut-2-enoxy)phenyl]methyl]ethanamine
CID 63057303

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide?
The IUPAC name of 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide (CID 63057446) is 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide.
What is the SMILES notation for 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide?
The canonical SMILES for 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide is CNC(=O)C(C)Oc1cc(CNCCOC)ccc1OC.
What is the InChIKey of 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide?
The InChIKey is KOAHGPWVSFJLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-11(15(18)16-2)21-14-9-12(5-6-13(14)20-4)10-17-7-8-19-3/h5-6,9,11,17H,7-8,10H2,1-4H3,(H,16,18).
What are the key properties of 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide?
2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide has a molecular weight of 296.37 g/mol, XLogP of 0.94, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-5-[(2-methoxyethylamino)methyl]phenoxy]-N-methylpropanamide is sourced from PubChem (CID 63057446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).