2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide

C15H15ClN2O2 — CID 39107715

IUPAC2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
SMILESCc1c(Cl)cccc1NC(=O)COc1cccc(N)c1
InChIInChI=1S/C15H15ClN2O2/c1-10-13(16)6-3-7-14(10)18-15(19)9-20-12-5-2-4-11(17)8-12/h2-8H,9,17H2,1H3,(H,18,19)
InChIKeyRRCIGUDEXFOHGC-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.25
Rot. Bonds4

About 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide

2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide (PubChem CID 39107715) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
PubChem CID39107715
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
SMILESCc1c(Cl)cccc1NC(=O)COc1cccc(N)c1
InChIInChI=1S/C15H15ClN2O2/c1-10-13(16)6-3-7-14(10)18-15(19)9-20-12-5-2-4-11(17)8-12/h2-8H,9,17H2,1H3,(H,18,19)
InChIKeyRRCIGUDEXFOHGC-UHFFFAOYSA-N
XLogP3.25
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.25
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

N-(3-chloro-2-methylphenyl)-2-(3,5-dimethylphenoxy)acetamide
CID 679560
2-(3-acetamidophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
CID 964555
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 2-(3-chlorophenoxy)acetate
CID 40564745
N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 759065
N-(3-chloro-2-methylphenyl)-2-(3-nitrophenoxy)acetamide
CID 7865374
2-(3-aminophenoxy)-N-(2-methylsulfanylphenyl)acetamide
CID 61034938
2-(3-aminophenoxy)-N-(2,4-dimethylphenyl)acetamide
CID 39107625
N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 835994
N-(3-chloro-2-methylphenyl)-2-[3-(2,5-dihydrotetrazol-1-yl)phenoxy]acetamide
CID 90125220
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 3-(3-methylphenoxy)propanoate
CID 9139420
4-[2-[2-(4-chloro-3-methylphenoxy)acetyl]hydrazinyl]-N-(3-chloro-2-methylphenyl)-4-oxobutanamide
CID 3550722
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 4-aminobenzoate
CID 7781202

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide?
The IUPAC name of 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide (CID 39107715) is 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide is Cc1c(Cl)cccc1NC(=O)COc1cccc(N)c1.
What is the InChIKey of 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide?
The InChIKey is RRCIGUDEXFOHGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-13(16)6-3-7-14(10)18-15(19)9-20-12-5-2-4-11(17)8-12/h2-8H,9,17H2,1H3,(H,18,19).
What are the key properties of 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide?
2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide is sourced from PubChem (CID 39107715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).