2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide

C18H21NO3 — CID 42892656

IUPAC2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide
SMILESCOc1ccc(OC(C)C(=O)NCc2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO3/c1-13-4-6-15(7-5-13)12-19-18(20)14(2)22-17-10-8-16(21-3)9-11-17/h4-11,14H,12H2,1-3H3,(H,19,20)
InChIKeyIIPBPIXWTFAXKU-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.09
Rot. Bonds6

About 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide

2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide (PubChem CID 42892656) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide
PubChem CID42892656
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide
SMILESCOc1ccc(OC(C)C(=O)NCc2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO3/c1-13-4-6-15(7-5-13)12-19-18(20)14(2)22-17-10-8-16(21-3)9-11-17/h4-11,14H,12H2,1-3H3,(H,19,20)
InChIKeyIIPBPIXWTFAXKU-UHFFFAOYSA-N
XLogP3.09
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide
CID 4221032
(2S)-2-(7-methoxynaphthalen-2-yl)oxy-N-[(4-methylphenyl)methyl]propanamide
CID 8949471
(2S)-N-[(4-methoxyphenyl)methyl]-2-phenoxypropanamide
CID 831480
(2S)-2-(4-chlorophenoxy)-N-[(4-methoxyphenyl)methyl]propanamide
CID 2711643
(2R)-N-[(4-methylphenyl)methyl]-2-phenoxypropanamide
CID 670065
2-(4-methylphenoxy)-N-(pyridin-4-ylmethyl)propanamide
CID 6490042
2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]butanamide
CID 21368209
2-(4-methylphenoxy)-N-[(4-sulfamoylphenyl)methyl]propanamide
CID 54783367
methyl 4-methoxy-2-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl]oxybenzoate
CID 26563881
2-(4-methylphenoxy)-N-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]propanamide
CID 24509083
(2R)-2-(3-fluorophenoxy)-N-[(4-methoxyphenyl)methyl]propanamide
CID 7834533
2-(4-methoxyphenoxy)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide
CID 46767803

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide (CID 42892656) is 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide is COc1ccc(OC(C)C(=O)NCc2ccc(C)cc2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide?
The InChIKey is IIPBPIXWTFAXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-13-4-6-15(7-5-13)12-19-18(20)14(2)22-17-10-8-16(21-3)9-11-17/h4-11,14H,12H2,1-3H3,(H,19,20).
What are the key properties of 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide?
2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide has a molecular weight of 299.37 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide is sourced from PubChem (CID 42892656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).