N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide

C16H18N2O3 — CID 24708109

IUPACN-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide
SMILESCOc1cccc(COCC(=O)Nc2ccc(N)cc2)c1
InChIInChI=1S/C16H18N2O3/c1-20-15-4-2-3-12(9-15)10-21-11-16(19)18-14-7-5-13(17)6-8-14/h2-9H,10-11,17H2,1H3,(H,18,19)
InChIKeyGWOLMJCFJSZNGH-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.43
Rot. Bonds6

About N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide

N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide (PubChem CID 24708109) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide
PubChem CID24708109
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide
SMILESCOc1cccc(COCC(=O)Nc2ccc(N)cc2)c1
InChIInChI=1S/C16H18N2O3/c1-20-15-4-2-3-12(9-15)10-21-11-16(19)18-14-7-5-13(17)6-8-14/h2-9H,10-11,17H2,1H3,(H,18,19)
InChIKeyGWOLMJCFJSZNGH-UHFFFAOYSA-N
XLogP2.43
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide
CID 24701706
2-[(3-methoxyphenyl)methoxy]-N-(4-methylsulfanylphenyl)acetamide
CID 46493576
N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide
CID 43823143
(3-methoxyphenyl)methyl N-(4-aminophenyl)carbamate
CID 43469136
[2-(4-fluoroanilino)-2-oxoethyl] 2-(3-methoxyphenyl)acetate
CID 7840231
(3-methoxyphenyl)methyl N-[4-(aminomethyl)phenyl]carbamate
CID 43309306
2-(3-methoxyphenyl)-N-phenylacetamide
CID 2598681
(3R)-3-[[2-[(3-methoxyphenyl)methoxy]acetyl]amino]butanoic acid
CID 97234234
ethyl 4-[(3-methoxyphenyl)methoxy]-3-oxobutanoate
CID 63892220
N-(4-aminophenyl)-3-methoxybenzamide
CID 8566724
[2-(3,5-dimethylanilino)-2-oxoethyl] 2-(3-methoxyphenyl)acetate
CID 7840224
2-[4-[2-[(3-methoxyphenyl)methoxy]acetyl]piperazin-1-yl]-N-phenylacetamide
CID 46472029

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide?
The IUPAC name of N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide (CID 24708109) is N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide.
What is the SMILES notation for N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide?
The canonical SMILES for N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide is COc1cccc(COCC(=O)Nc2ccc(N)cc2)c1.
What is the InChIKey of N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide?
The InChIKey is GWOLMJCFJSZNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-20-15-4-2-3-12(9-15)10-21-11-16(19)18-14-7-5-13(17)6-8-14/h2-9H,10-11,17H2,1H3,(H,18,19).
What are the key properties of N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide?
N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide has a molecular weight of 286.33 g/mol, XLogP of 2.43, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide is sourced from PubChem (CID 24708109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).