N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide

C19H23NO3 — CID 93165804

IUPACN-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide
SMILESCOc1ccc(CCCNC(=O)COc2ccc(C)cc2)cc1
InChIInChI=1S/C19H23NO3/c1-15-5-9-18(10-6-15)23-14-19(21)20-13-3-4-16-7-11-17(22-2)12-8-16/h5-12H,3-4,13-14H2,1-2H3,(H,20,21)
InChIKeyRLCIFOWABOTJKD-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.13
Rot. Bonds8

About N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide

N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide (PubChem CID 93165804) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide
PubChem CID93165804
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide
SMILESCOc1ccc(CCCNC(=O)COc2ccc(C)cc2)cc1
InChIInChI=1S/C19H23NO3/c1-15-5-9-18(10-6-15)23-14-19(21)20-13-3-4-16-7-11-17(22-2)12-8-16/h5-12H,3-4,13-14H2,1-2H3,(H,20,21)
InChIKeyRLCIFOWABOTJKD-UHFFFAOYSA-N
XLogP3.13
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-[2-[3-(4-methylphenyl)propylamino]-2-oxoethoxy]phenyl]propanamide
CID 50979662
2-amino-N-[3-(4-methoxyphenyl)propyl]acetamide
CID 119299625
2-(4-methoxyphenoxy)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 95172596
4-methoxy-N-[2-[[2-(4-methylphenoxy)acetyl]amino]ethyl]benzamide
CID 108537866
N-(3-acetamidopropyl)-2-(4-methylphenoxy)acetamide
CID 110292109
N-[(4-methoxyphenyl)methyl]-2-[[2-(4-methylphenoxy)acetyl]amino]acetamide
CID 48501757
N-[2-(4-aminophenyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 39384693
N-[2-(4-chlorophenyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 2632440
N-(3-aminopropyl)-2-(4-methylphenoxy)acetamide;hydrochloride
CID 119405354
methyl 4-[2-[[2-(4-methoxyphenoxy)acetyl]amino]ethyl]benzoate
CID 36774109
N-[3-(4-ethoxyphenyl)propyl]-2-methoxyacetamide
CID 100569556
N-[3-(4-methoxyphenyl)propyl]-2-(4-phenylphenyl)acetamide
CID 100516355

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide (CID 93165804) is N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide is COc1ccc(CCCNC(=O)COc2ccc(C)cc2)cc1.
What is the InChIKey of N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide?
The InChIKey is RLCIFOWABOTJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-15-5-9-18(10-6-15)23-14-19(21)20-13-3-4-16-7-11-17(22-2)12-8-16/h5-12H,3-4,13-14H2,1-2H3,(H,20,21).
What are the key properties of N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide?
N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide has a molecular weight of 313.40 g/mol, XLogP of 3.13, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 93165804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).