N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide

C16H18N2O2 — CID 61261456

IUPACN-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OC(C)c1cccc(N)c1
InChIInChI=1S/C16H18N2O2/c1-11(13-6-5-7-14(17)10-13)20-16-9-4-3-8-15(16)18-12(2)19/h3-11H,17H2,1-2H3,(H,18,19)
InChIKeyRIDDCEAWJYMFEK-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.37
Rot. Bonds4

About N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide

N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide (PubChem CID 61261456) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide
PubChem CID61261456
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OC(C)c1cccc(N)c1
InChIInChI=1S/C16H18N2O2/c1-11(13-6-5-7-14(17)10-13)20-16-9-4-3-8-15(16)18-12(2)19/h3-11H,17H2,1-2H3,(H,18,19)
InChIKeyRIDDCEAWJYMFEK-UHFFFAOYSA-N
XLogP3.37
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.37
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

methyl 2-(2-acetamidophenoxy)propanoate
CID 54941686
3-[1-(2-bromophenoxy)ethyl]aniline
CID 61262951
3-amino-N-(2-propan-2-yloxyphenyl)benzamide
CID 28722379
N-[2-[2-(3-aminophenoxy)ethoxy]phenyl]acetamide
CID 43174395
N-[2-(4-oxopentan-2-yloxy)phenyl]acetamide
CID 64698163
3-[1-(2-chloro-4-fluorophenoxy)ethyl]aniline
CID 61263144
methyl 5-amino-2-(1-phenylethoxy)benzoate
CID 61306335
(2-acetamidophenyl) hypochlorite
CID 150463309
3-[1-(3-bromophenoxy)ethyl]aniline
CID 61263689
4-(methylamino)-N-[2-(1-phenylethoxy)phenyl]butanamide;hydrochloride
CID 119792496
3-[1-(2-chloro-5-methylphenoxy)ethyl]aniline
CID 61262210
N,N'-bis(2-propan-2-yloxyphenyl)oxamide
CID 108987298

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide?
The IUPAC name of N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide (CID 61261456) is N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide.
What is the SMILES notation for N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide?
The canonical SMILES for N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide is CC(=O)Nc1ccccc1OC(C)c1cccc(N)c1.
What is the InChIKey of N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide?
The InChIKey is RIDDCEAWJYMFEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11(13-6-5-7-14(17)10-13)20-16-9-4-3-8-15(16)18-12(2)19/h3-11H,17H2,1-2H3,(H,18,19).
What are the key properties of N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide?
N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide has a molecular weight of 270.33 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(3-aminophenyl)ethoxy]phenyl]acetamide is sourced from PubChem (CID 61261456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).