N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide

C18H19NO3 — CID 78760468

IUPACN-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide
SMILESCCC(=O)c1ccc(OCC(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C18H19NO3/c1-3-17(20)14-9-11-16(12-10-14)22-13-18(21)19(2)15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3
InChIKeyKFEQQOOKEJTDCS-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.32
Rot. Bonds6

About N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide

N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide (PubChem CID 78760468) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide.

Molecular Properties

Compound NameN-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide
PubChem CID78760468
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC NameN-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide
SMILESCCC(=O)c1ccc(OCC(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C18H19NO3/c1-3-17(20)14-9-11-16(12-10-14)22-13-18(21)19(2)15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3
InChIKeyKFEQQOOKEJTDCS-UHFFFAOYSA-N
XLogP3.32
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenoxy)-N-methyl-N-phenylacetamide
CID 888242
[(2R)-1-(N-methylanilino)-1-oxopropan-2-yl] 2-(4-propanoylphenoxy)acetate
CID 9326463
N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide
CID 43243911
ethyl 2-(N-[2-[2-(4-propanoylphenoxy)acetyl]oxyacetyl]anilino)acetate
CID 55318197
3-[methyl-[2-(4-propanoylphenoxy)acetyl]amino]propanoic acid
CID 75405754
1-phenyl-3-(4-propanoylphenoxy)propan-1-one
CID 116692107
2-[4-[(4-ethoxyphenyl)sulfonyl-methylamino]phenoxy]-N-methyl-N-phenylacetamide
CID 55346376
[2-(N-methylanilino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
CID 2365643
2-(3-fluorophenoxy)-N-methyl-N-phenylacetamide
CID 78762284
[2-(N-methylanilino)-2-oxoethyl] 2-(4-phenylmethoxyphenoxy)acetate
CID 9139029
2-(1,3-benzodioxol-5-yloxy)-N-methyl-N-phenylacetamide
CID 17310206
N-methyl-2-(4-propanoylphenoxy)-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 55550790

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide?
The IUPAC name of N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide (CID 78760468) is N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide.
What is the SMILES notation for N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide?
The canonical SMILES for N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide is CCC(=O)c1ccc(OCC(=O)N(C)c2ccccc2)cc1.
What is the InChIKey of N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide?
The InChIKey is KFEQQOOKEJTDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-3-17(20)14-9-11-16(12-10-14)22-13-18(21)19(2)15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3.
What are the key properties of N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide?
N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide has a molecular weight of 297.35 g/mol, XLogP of 3.32, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide is sourced from PubChem (CID 78760468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).