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

C16H17ClN2O2 — CID 28867352

IUPACN-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)Nc2ccc(N)cc2Cl)c1C
InChIInChI=1S/C16H17ClN2O2/c1-10-4-3-5-15(11(10)2)21-9-16(20)19-14-7-6-12(18)8-13(14)17/h3-8H,9,18H2,1-2H3,(H,19,20)
InChIKeyFUIZXKMZMJSTQJ-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.56
Rot. Bonds4

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

N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide (PubChem CID 28867352) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide
PubChem CID28867352
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)Nc2ccc(N)cc2Cl)c1C
InChIInChI=1S/C16H17ClN2O2/c1-10-4-3-5-15(11(10)2)21-9-16(20)19-14-7-6-12(18)8-13(14)17/h3-8H,9,18H2,1-2H3,(H,19,20)
InChIKeyFUIZXKMZMJSTQJ-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

N-(2-chloro-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 18075657
N-(5-amino-2-methylphenyl)-2-(2,3-dichlorophenoxy)acetamide
CID 28537130
N-(5-chloro-2-fluorophenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 8759085
methyl 4-chloro-3-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoate
CID 8909813
N-(4-amino-2-chlorophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 60970761
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 7982074
2-(2,3-dimethylphenoxy)-N-(2,5-dimethylphenyl)acetamide
CID 720593
N-(4-amino-2-chlorophenyl)-2-(2,5-dichlorophenoxy)acetamide
CID 28542842
N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide
CID 17099005
3-amino-N-[2-[[2-(2,3-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 82034375
N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 28867346
2-(2,3-dimethylphenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide
CID 17380454

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide?
The IUPAC name of N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide (CID 28867352) is N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide?
The canonical SMILES for N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide is Cc1cccc(OCC(=O)Nc2ccc(N)cc2Cl)c1C.
What is the InChIKey of N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide?
The InChIKey is FUIZXKMZMJSTQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-10-4-3-5-15(11(10)2)21-9-16(20)19-14-7-6-12(18)8-13(14)17/h3-8H,9,18H2,1-2H3,(H,19,20).
What are the key properties of N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide?
N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)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 N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide is sourced from PubChem (CID 28867352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).