2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide

C16H18N2O3 — CID 961527

IUPAC2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide
SMILESCOc1cc(CNc2ccccc2)ccc1OCC(N)=O
InChIInChI=1S/C16H18N2O3/c1-20-15-9-12(7-8-14(15)21-11-16(17)19)10-18-13-5-3-2-4-6-13/h2-9,18H,10-11H2,1H3,(H2,17,19)
InChIKeyGGZGQENPADDLQW-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.17
Rot. Bonds7

About 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide

2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide (PubChem CID 961527) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide.

Molecular Properties

Compound Name2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide
PubChem CID961527
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide
SMILESCOc1cc(CNc2ccccc2)ccc1OCC(N)=O
InChIInChI=1S/C16H18N2O3/c1-20-15-9-12(7-8-14(15)21-11-16(17)19)10-18-13-5-3-2-4-6-13/h2-9,18H,10-11H2,1H3,(H2,17,19)
InChIKeyGGZGQENPADDLQW-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

N-[3-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylamino]phenyl]-2-methylpropanamide
CID 19644382
2-[4-[(iodoamino)methyl]-2-methoxyphenoxy]acetamide
CID 129301598
2-[2-methoxy-4-[[[(1R)-1-phenylethyl]amino]methyl]phenoxy]acetamide
CID 7384832
2-[4-[(3-chloro-4-fluoroanilino)methyl]-2-methoxyphenoxy]acetamide
CID 66525668
2-[4-(anilinomethyl)-2-methoxyphenoxy]-N-(4-fluorophenyl)acetamide
CID 3917191
3-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylamino]propanoic acid
CID 102536557
4-(2-amino-2-oxoethoxy)-N-[(3,4-dimethoxyphenyl)methyl]-3-methoxybenzamide
CID 9082611
2-[4-[[(2-hydroxy-2-phenylethyl)amino]methyl]-2-methoxyphenoxy]acetamide chloride
CID 21233673
2-[2-methoxy-4-[(4-phenoxyanilino)methyl]phenoxy]-N-phenylacetamide
CID 126273736
2-[2-methoxy-4-[[2-(2-methoxyphenyl)ethylamino]methyl]phenoxy]acetamide
CID 17207216
2-[2-methoxy-4-[(prop-2-ynylamino)methyl]phenoxy]acetamide
CID 94074154
2-[2-methoxy-4-(propylaminomethyl)phenoxy]acetamide;hydrochloride
CID 17290875

Frequently Asked Questions

What is the IUPAC name of 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide?
The IUPAC name of 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide (CID 961527) is 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide.
What is the SMILES notation for 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide?
The canonical SMILES for 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide is COc1cc(CNc2ccccc2)ccc1OCC(N)=O.
What is the InChIKey of 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide?
The InChIKey is GGZGQENPADDLQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-20-15-9-12(7-8-14(15)21-11-16(17)19)10-18-13-5-3-2-4-6-13/h2-9,18H,10-11H2,1H3,(H2,17,19).
What are the key properties of 2-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide?
2-[4-(anilinomethyl)-2-methoxyphenoxy]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-[4-(anilinomethyl)-2-methoxyphenoxy]acetamide is sourced from PubChem (CID 961527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).