N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide

C18H19NO4 — CID 19203966

IUPACN-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide
SMILESCOc1cccc(OC(C)C(=O)Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C18H19NO4/c1-12(20)14-7-9-15(10-8-14)19-18(21)13(2)23-17-6-4-5-16(11-17)22-3/h4-11,13H,1-3H3,(H,19,21)
InChIKeyUXQXYAZUMRKHLE-UHFFFAOYSA-N
MW313.35 g/mol
LogP3.30
Rot. Bonds6

About N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide

N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide (PubChem CID 19203966) has the molecular formula C18H19NO4 and a molecular weight of 313.35 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide
PubChem CID19203966
Molecular FormulaC18H19NO4
Molecular Weight313.35 g/mol
Exact Mass313.13
IUPAC NameN-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide
SMILESCOc1cccc(OC(C)C(=O)Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C18H19NO4/c1-12(20)14-7-9-15(10-8-14)19-18(21)13(2)23-17-6-4-5-16(11-17)22-3/h4-11,13H,1-3H3,(H,19,21)
InChIKeyUXQXYAZUMRKHLE-UHFFFAOYSA-N
XLogP3.30
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.35
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[2-(3-methoxyphenoxy)propanoylamino]benzoate
CID 19203887
4-[2-(3-methoxyphenoxy)propanoylamino]benzoic acid
CID 43905180
2-(3-methoxyphenoxy)-N-(4-methoxyphenyl)propanamide
CID 19203873
(2S)-N-(4-acetylphenyl)-2-(3-fluorophenoxy)propanamide
CID 7834470
N-(4-chlorophenyl)-2-(3-methoxyphenoxy)propanamide
CID 19203909
2-(4-acetamidophenoxy)-N-(3-methoxyphenyl)propanamide
CID 4884235
N-(4-acetylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 53266489
[(2S)-1-(4-acetylanilino)-1-oxopropan-2-yl] (2R)-2-(3-methylphenoxy)propanoate
CID 2397766
2-(3-bromophenoxy)-N-(4-methoxyphenyl)propanamide
CID 2793539
methyl 3-[2-(4-acetylphenoxy)propanoylamino]benzoate
CID 17413178
(2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 9238804
N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 4953600

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide?
The IUPAC name of N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide (CID 19203966) is N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide?
The canonical SMILES for N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide is COc1cccc(OC(C)C(=O)Nc2ccc(C(C)=O)cc2)c1.
What is the InChIKey of N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide?
The InChIKey is UXQXYAZUMRKHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO4/c1-12(20)14-7-9-15(10-8-14)19-18(21)13(2)23-17-6-4-5-16(11-17)22-3/h4-11,13H,1-3H3,(H,19,21).
What are the key properties of N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide?
N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide has a molecular weight of 313.35 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-(3-methoxyphenoxy)propanamide is sourced from PubChem (CID 19203966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).