N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide

C19H22N2O3 — CID 112978105

IUPACN-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)COc2cc(C)c(C)cc2C)c1
InChIInChI=1S/C19H22N2O3/c1-12-8-14(3)18(9-13(12)2)24-11-19(23)21-17-7-5-6-16(10-17)20-15(4)22/h5-10H,11H2,1-4H3,(H,20,22)(H,21,23)
InChIKeyZVRMFCRVTRGAAI-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.59
Rot. Bonds5

About N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide

N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide (PubChem CID 112978105) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide
PubChem CID112978105
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)COc2cc(C)c(C)cc2C)c1
InChIInChI=1S/C19H22N2O3/c1-12-8-14(3)18(9-13(12)2)24-11-19(23)21-17-7-5-6-16(10-17)20-15(4)22/h5-10H,11H2,1-4H3,(H,20,22)(H,21,23)
InChIKeyZVRMFCRVTRGAAI-UHFFFAOYSA-N
XLogP3.59
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[[2-(2,4,5-trimethylphenoxy)acetyl]amino]phenyl] acetate
CID 17341793
N-(4-acetylphenyl)-2-(2,4,5-trimethylphenoxy)acetamide
CID 17360274
N-[3-[2-(2,4,5-trimethylphenoxy)ethylcarbamoylamino]phenyl]acetamide
CID 112974507
N-[3-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 17188255
N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 17172943
N-(1,3-thiazol-2-yl)-3-[[2-(2,4,5-trimethylphenoxy)acetyl]amino]benzamide
CID 17296385
2-(4-bromo-2,5-dimethylphenoxy)-N-(3-cyanophenyl)acetamide
CID 4270480
2-(2-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 747103
2-(2-acetamidophenoxy)-N-(3-methylphenyl)acetamide
CID 7867297
N-(3-acetylphenyl)-2-(4-bromo-2-methylphenoxy)acetamide
CID 1013855
N-(3-bromophenyl)-2-(2,5-dimethylphenoxy)acetamide
CID 17252160
N-(3-bromophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 876443

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide (CID 112978105) is N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide is CC(=O)Nc1cccc(NC(=O)COc2cc(C)c(C)cc2C)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide?
The InChIKey is ZVRMFCRVTRGAAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-12-8-14(3)18(9-13(12)2)24-11-19(23)21-17-7-5-6-16(10-17)20-15(4)22/h5-10H,11H2,1-4H3,(H,20,22)(H,21,23).
What are the key properties of N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide?
N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide has a molecular weight of 326.40 g/mol, XLogP of 3.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(2,4,5-trimethylphenoxy)acetamide is sourced from PubChem (CID 112978105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).