2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide

C16H18N2O3 — CID 43720165

IUPAC2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide
SMILESCOc1ccc(CNc2cccc(OCC(N)=O)c2)cc1
InChIInChI=1S/C16H18N2O3/c1-20-14-7-5-12(6-8-14)10-18-13-3-2-4-15(9-13)21-11-16(17)19/h2-9,18H,10-11H2,1H3,(H2,17,19)
InChIKeyUEGSTAUIRQLKEK-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.17
Rot. Bonds7

About 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide

2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide (PubChem CID 43720165) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide.

Molecular Properties

Compound Name2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide
PubChem CID43720165
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide
SMILESCOc1ccc(CNc2cccc(OCC(N)=O)c2)cc1
InChIInChI=1S/C16H18N2O3/c1-20-14-7-5-12(6-8-14)10-18-13-3-2-4-15(9-13)21-11-16(17)19/h2-9,18H,10-11H2,1H3,(H2,17,19)
InChIKeyUEGSTAUIRQLKEK-UHFFFAOYSA-N
XLogP2.17
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-[(3-bromo-4-methylphenyl)methylamino]phenoxy]acetamide
CID 115876092
2-[3-[(2-ethylphenyl)methylamino]phenoxy]acetamide
CID 62391235
N-[(4-methoxyphenyl)methyl]-3-phenylmethoxyaniline
CID 54801333
2-[3-(2-methylpropylamino)phenoxy]acetamide
CID 43720195
2-[3-[(2,3-dihydroxyphenyl)methylamino]phenoxy]acetamide
CID 61317866
2-[3-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]phenoxy]acetamide
CID 79156755
2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide
CID 43720191
2-[3-[[5-(hydroxymethyl)furan-2-yl]methylamino]phenoxy]acetamide
CID 64579004
2-[3-[(1-propylpyrrol-3-yl)methylamino]phenoxy]acetamide
CID 66414941
2-[3-(2-phenylethylamino)phenoxy]acetamide
CID 43720190
2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide
CID 175971606
2-[3-[(3-aminothiophen-2-yl)methylamino]phenoxy]acetamide
CID 66386950

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide?
The IUPAC name of 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide (CID 43720165) is 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide.
What is the SMILES notation for 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide?
The canonical SMILES for 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide is COc1ccc(CNc2cccc(OCC(N)=O)c2)cc1.
What is the InChIKey of 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide?
The InChIKey is UEGSTAUIRQLKEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-20-14-7-5-12(6-8-14)10-18-13-3-2-4-15(9-13)21-11-16(17)19/h2-9,18H,10-11H2,1H3,(H2,17,19).
What are the key properties of 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide?
2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide has a molecular weight of 286.33 g/mol, XLogP of 2.17, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide is sourced from PubChem (CID 43720165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).