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

C17H20N2O2 — CID 43376403

IUPACN-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(C)c(N)c2)c(C)c1
InChIInChI=1S/C17H20N2O2/c1-11-4-7-16(13(3)8-11)21-10-17(20)19-14-6-5-12(2)15(18)9-14/h4-9H,10,18H2,1-3H3,(H,19,20)
InChIKeyZHHBMWIKOUIDSD-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.21
Rot. Bonds4

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

N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide (PubChem CID 43376403) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide
PubChem CID43376403
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(C)c(N)c2)c(C)c1
InChIInChI=1S/C17H20N2O2/c1-11-4-7-16(13(3)8-11)21-10-17(20)19-14-6-5-12(2)15(18)9-14/h4-9H,10,18H2,1-3H3,(H,19,20)
InChIKeyZHHBMWIKOUIDSD-UHFFFAOYSA-N
XLogP3.21
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.21
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-amino-4-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 28867302
N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 28867346
N-(3-amino-4-fluorophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 29036010
N-(3-chloro-4-fluorophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 800993
N-(3-amino-4-methoxyphenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 50878679
2-(2,4-dimethylphenoxy)-N-(4-methylsulfonylphenyl)acetamide
CID 26239246
N-(3-bromophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 876443
methyl 2-[4-[[2-(2,4-dimethylphenoxy)acetyl]amino]phenoxy]acetate
CID 894367
N-(3-amino-2-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 16781912
N-(4-aminophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 16789348
N-(4,6-diamino-1,3,5-triazin-2-yl)-2-(2,4-dimethylphenoxy)acetamide
CID 70962503
2-(2,4-dimethylphenoxy)-N-(3-methylsulfanylphenyl)acetamide
CID 837829

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide (CID 43376403) is N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide is Cc1ccc(OCC(=O)Nc2ccc(C)c(N)c2)c(C)c1.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide?
The InChIKey is ZHHBMWIKOUIDSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-11-4-7-16(13(3)8-11)21-10-17(20)19-14-6-5-12(2)15(18)9-14/h4-9H,10,18H2,1-3H3,(H,19,20).
What are the key properties of N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide?
N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide has a molecular weight of 284.36 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide is sourced from PubChem (CID 43376403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).