2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide

C17H20N2O2 — CID 61102582

IUPAC2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(C(C)NC(=O)Cc2ccccc2N)c1
InChIInChI=1S/C17H20N2O2/c1-12(13-7-5-8-15(10-13)21-2)19-17(20)11-14-6-3-4-9-16(14)18/h3-10,12H,11,18H2,1-2H3,(H,19,20)
InChIKeyDSDBACRMIQRFTG-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.70
Rot. Bonds5

About 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide

2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide (PubChem CID 61102582) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide
PubChem CID61102582
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(C(C)NC(=O)Cc2ccccc2N)c1
InChIInChI=1S/C17H20N2O2/c1-12(13-7-5-8-15(10-13)21-2)19-17(20)11-14-6-3-4-9-16(14)18/h3-10,12H,11,18H2,1-2H3,(H,19,20)
InChIKeyDSDBACRMIQRFTG-UHFFFAOYSA-N
XLogP2.70
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.70
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-(2-fluorophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide
CID 6470392
(3R)-3-amino-4-(2-fluorophenyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]butanamide
CID 11522773
N-[(1S)-1-(3-methoxyphenyl)ethyl]butanamide
CID 40636094
2-amino-N-[(1R)-1-(3-methoxyphenyl)ethyl]propanamide
CID 81372926
(2R)-2-amino-N-[(1R)-1-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 81354308
2-(2-aminophenyl)-N-[1-(4-methylphenyl)ethyl]acetamide
CID 61102579
2-(5-amino-2-pyridinyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide;hydrochloride
CID 120620251
2-(2-aminophenyl)-N-[1-(4-bromophenyl)ethyl]acetamide
CID 61118326
N-[2-[[(1R)-1-(3-methoxyphenyl)ethyl]carbamoylamino]ethyl]-2-methylpropanamide
CID 119064075
(2S)-2-amino-N-[1-(3-methoxyphenyl)ethyl]-4-methylpentanamide
CID 61179411
(2R)-2-amino-N-[(1R)-1-(3-methoxyphenyl)ethyl]-4-methylpentanamide
CID 93359650
2-(aminomethyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]-3-methylbutanamide
CID 81373712

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide (CID 61102582) is 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide is COc1cccc(C(C)NC(=O)Cc2ccccc2N)c1.
What is the InChIKey of 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide?
The InChIKey is DSDBACRMIQRFTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12(13-7-5-8-15(10-13)21-2)19-17(20)11-14-6-3-4-9-16(14)18/h3-10,12H,11,18H2,1-2H3,(H,19,20).
What are the key properties of 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide?
2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide has a molecular weight of 284.36 g/mol, XLogP of 2.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 61102582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).