2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide

C17H20N2O2 — CID 28711957

IUPAC2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(CCNC(=O)Cc2cccc(N)c2)c1
InChIInChI=1S/C17H20N2O2/c1-21-16-7-3-4-13(11-16)8-9-19-17(20)12-14-5-2-6-15(18)10-14/h2-7,10-11H,8-9,12,18H2,1H3,(H,19,20)
InChIKeyWLLFIYIATAHMNI-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.18
Rot. Bonds6

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

2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide (PubChem CID 28711957) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
PubChem CID28711957
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(CCNC(=O)Cc2cccc(N)c2)c1
InChIInChI=1S/C17H20N2O2/c1-21-16-7-3-4-13(11-16)8-9-19-17(20)12-14-5-2-6-15(18)10-14/h2-7,10-11H,8-9,12,18H2,1H3,(H,19,20)
InChIKeyWLLFIYIATAHMNI-UHFFFAOYSA-N
XLogP2.18
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22690352
N-[2-(4-hydroxyphenyl)ethyl]-2-(3-methoxyphenyl)acetamide
CID 61017914
N-[2-(4-aminophenyl)ethyl]-3-(3-methoxyphenyl)propanamide
CID 119549328
N-[2-(3-methoxyphenyl)ethyl]-2-(3-phenylmethoxyphenyl)acetamide
CID 13406973
2-hydroxy-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 94681482
2-(3-aminophenyl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 28711954
2-[3,5-bis(phenylmethoxy)phenyl]-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 564164
methyl N-[2-[2-(3-methoxyphenyl)ethylamino]-2-oxoethyl]carbamate
CID 47308059
N-[2-(3-methoxyphenyl)ethyl]-2-oxopropanamide
CID 110478240
4-[2-(3-methoxyphenyl)ethylamino]-4-oxobutanoic acid;hydrochloride
CID 170649983
N-(3-iodopropyl)-2-(3-methoxyphenyl)acetamide
CID 114504420
N-[2-(2-methoxyethoxy)ethyl]-2-(3-methoxyphenyl)acetamide
CID 86985384

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide (CID 28711957) is 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide is COc1cccc(CCNC(=O)Cc2cccc(N)c2)c1.
What is the InChIKey of 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The InChIKey is WLLFIYIATAHMNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-21-16-7-3-4-13(11-16)8-9-19-17(20)12-14-5-2-6-15(18)10-14/h2-7,10-11H,8-9,12,18H2,1H3,(H,19,20).
What are the key properties of 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide has a molecular weight of 284.36 g/mol, XLogP of 2.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 28711957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).