2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide

C16H17ClN2O2 — CID 62056523

IUPAC2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide
SMILESCc1cc(C)c(OCC(=O)Nc2cccc(Cl)c2)c(N)c1
InChIInChI=1S/C16H17ClN2O2/c1-10-6-11(2)16(14(18)7-10)21-9-15(20)19-13-5-3-4-12(17)8-13/h3-8H,9,18H2,1-2H3,(H,19,20)
InChIKeySALWFIUNMUENHQ-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.56
Rot. Bonds4

About 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide

2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide (PubChem CID 62056523) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide
PubChem CID62056523
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC Name2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide
SMILESCc1cc(C)c(OCC(=O)Nc2cccc(Cl)c2)c(N)c1
InChIInChI=1S/C16H17ClN2O2/c1-10-6-11(2)16(14(18)7-10)21-9-15(20)19-13-5-3-4-12(17)8-13/h3-8H,9,18H2,1-2H3,(H,19,20)
InChIKeySALWFIUNMUENHQ-UHFFFAOYSA-N
XLogP3.56
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.56
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-amino-4,6-dimethylphenoxy)-N-phenylacetamide
CID 62056347
2-(2-amino-4-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 61313800
N-(3-chlorophenyl)-2-(2,3,5-trimethylphenoxy)acetamide
CID 19177306
[2-(3-chloroanilino)-2-oxoethyl] 2-(2,6-dimethylphenoxy)acetate
CID 8528048
2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide
CID 43379337
2-(2-amino-4-chlorophenoxy)-N-(3-methylphenyl)acetamide
CID 24695483
2-(2-chloro-4-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 161150821
2-chloro-N-[3-[[2-(2-chloro-4,6-dimethylphenoxy)acetyl]amino]phenyl]benzamide
CID 3877756
N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 28867327
2-(4-chloro-2,6-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)acetamide
CID 7642269
2-(2-amino-4,6-dimethylphenoxy)-N-ethylacetamide
CID 62057922
2-(4-bromo-2-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 3483118

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide (CID 62056523) is 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide is Cc1cc(C)c(OCC(=O)Nc2cccc(Cl)c2)c(N)c1.
What is the InChIKey of 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide?
The InChIKey is SALWFIUNMUENHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-10-6-11(2)16(14(18)7-10)21-9-15(20)19-13-5-3-4-12(17)8-13/h3-8H,9,18H2,1-2H3,(H,19,20).
What are the key properties of 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide?
2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide has a molecular weight of 304.78 g/mol, XLogP of 3.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 62056523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).