N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide

C18H19NO3 — CID 4798056

IUPACN-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)COc2ccc(C)cc2)cc1
InChIInChI=1S/C18H19NO3/c1-3-18(21)19-15-8-6-14(7-9-15)17(20)12-22-16-10-4-13(2)5-11-16/h4-11H,3,12H2,1-2H3,(H,19,21)
InChIKeyVIVOVMZCQYOOGC-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.61
Rot. Bonds6

About N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide

N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide (PubChem CID 4798056) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide.

Molecular Properties

Compound NameN-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide
PubChem CID4798056
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC NameN-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)COc2ccc(C)cc2)cc1
InChIInChI=1S/C18H19NO3/c1-3-18(21)19-15-8-6-14(7-9-15)17(20)12-22-16-10-4-13(2)5-11-16/h4-11H,3,12H2,1-2H3,(H,19,21)
InChIKeyVIVOVMZCQYOOGC-UHFFFAOYSA-N
XLogP3.61
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 4-methylbenzoate
CID 7971864
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
N-(4-ethoxyphenyl)-2-(4-propanoylphenoxy)acetamide
CID 2542308
N,N-diethyl-4-[[2-(4-methylphenoxy)acetyl]amino]benzamide
CID 7817272
N-[4-[2-(4-ethoxyphenoxy)acetyl]phenyl]acetamide
CID 2560779
4-(4-ethoxyphenyl)-4-oxo-N-[4-(propanoylamino)phenyl]butanamide
CID 55846229
4-(4-methylphenyl)-4-oxo-N-(4-propoxyphenyl)butanamide
CID 110493382
2-(4-acetylphenoxy)-1-(4-methylphenyl)ethanone
CID 60625443
2-(4-butoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 4732728
2-(4-methylphenoxy)-N-(4-propoxyphenyl)acetamide
CID 4943007
N-[4-[2-[3-(4-methylphenyl)propylamino]-2-oxoethoxy]phenyl]propanamide
CID 50979662
N-[4-[2-(4-cyano-3-fluorophenoxy)acetyl]phenyl]propanamide
CID 122134917

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide?
The IUPAC name of N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide (CID 4798056) is N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide.
What is the SMILES notation for N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide?
The canonical SMILES for N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide is CCC(=O)Nc1ccc(C(=O)COc2ccc(C)cc2)cc1.
What is the InChIKey of N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide?
The InChIKey is VIVOVMZCQYOOGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-3-18(21)19-15-8-6-14(7-9-15)17(20)12-22-16-10-4-13(2)5-11-16/h4-11H,3,12H2,1-2H3,(H,19,21).
What are the key properties of N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide?
N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide has a molecular weight of 297.35 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-methylphenoxy)acetyl]phenyl]propanamide is sourced from PubChem (CID 4798056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).