N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide

C18H21NO2 — CID 56706716

IUPACN-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide
SMILESCCC(=O)NCc1ccccc1-c1ccc(OC)cc1C
InChIInChI=1S/C18H21NO2/c1-4-18(20)19-12-14-7-5-6-8-17(14)16-10-9-15(21-3)11-13(16)2/h5-11H,4,12H2,1-3H3,(H,19,20)
InChIKeyHLTBIMHWOAZAQI-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.70
Rot. Bonds5

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

N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide (PubChem CID 56706716) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide.

Molecular Properties

Compound NameN-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide
PubChem CID56706716
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide
SMILESCCC(=O)NCc1ccccc1-c1ccc(OC)cc1C
InChIInChI=1S/C18H21NO2/c1-4-18(20)19-12-14-7-5-6-8-17(14)16-10-9-15(21-3)11-13(16)2/h5-11H,4,12H2,1-3H3,(H,19,20)
InChIKeyHLTBIMHWOAZAQI-UHFFFAOYSA-N
XLogP3.70
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(4-fluoro-2-methoxyphenyl)phenyl]methyl]propanamide
CID 56708842
2-(2,5-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 78806562
4-methoxy-2-methyl-1-(2-methylphenyl)benzene
CID 12981832
2-chloro-N-[(4-methoxy-2-methylphenyl)methyl]acetamide
CID 166403863
2-(2-hydroxyphenyl)-N-(4-methoxy-2-methylphenyl)acetamide
CID 78919759
2-(5-methoxy-1H-indol-3-yl)-N-[(2-methylphenyl)methyl]acetamide
CID 113209591
N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 115598846
4-methoxy-2-[2-[(2-methylphenyl)methylamino]-2-oxoethoxy]benzamide
CID 47014361
3-(2,5-dimethoxyanilino)-N-[(2-methylphenyl)methyl]propanamide
CID 109019183
N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780829
2-(2,5-dimethoxyphenyl)-N-(naphthalen-1-ylmethyl)acetamide
CID 78851833
N-[(2,4,5-trimethylphenyl)methyl]propanamide
CID 110783031

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide?
The IUPAC name of N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide (CID 56706716) is N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide.
What is the SMILES notation for N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide?
The canonical SMILES for N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide is CCC(=O)NCc1ccccc1-c1ccc(OC)cc1C.
What is the InChIKey of N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide?
The InChIKey is HLTBIMHWOAZAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-4-18(20)19-12-14-7-5-6-8-17(14)16-10-9-15(21-3)11-13(16)2/h5-11H,4,12H2,1-3H3,(H,19,20).
What are the key properties of N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide?
N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide has a molecular weight of 283.37 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-methoxy-2-methylphenyl)phenyl]methyl]propanamide is sourced from PubChem (CID 56706716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).