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

C18H21NO2 — CID 4221032

IUPAC2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide
SMILESCc1ccc(CNC(=O)C(C)Oc2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO2/c1-13-4-8-16(9-5-13)12-19-18(20)15(3)21-17-10-6-14(2)7-11-17/h4-11,15H,12H2,1-3H3,(H,19,20)
InChIKeyKOQQXDAXHHWMOI-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.39
Rot. Bonds5

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

2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide (PubChem CID 4221032) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide
PubChem CID4221032
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide
SMILESCc1ccc(CNC(=O)C(C)Oc2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO2/c1-13-4-8-16(9-5-13)12-19-18(20)15(3)21-17-10-6-14(2)7-11-17/h4-11,15H,12H2,1-3H3,(H,19,20)
InChIKeyKOQQXDAXHHWMOI-UHFFFAOYSA-N
XLogP3.39
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 ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide
CID 42892656
(2R)-N-[(4-methylphenyl)methyl]-2-phenoxypropanamide
CID 670065
2-(4-methylphenoxy)-N-(pyridin-4-ylmethyl)propanamide
CID 6490042
2-(4-methylphenoxy)-N-[(4-sulfamoylphenyl)methyl]propanamide
CID 54783367
(2S)-2-(7-methoxynaphthalen-2-yl)oxy-N-[(4-methylphenyl)methyl]propanamide
CID 8949471
2-(4-methylphenoxy)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide
CID 43043470
(2R)-2-phenoxy-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 93234508
2-(4-methylphenoxy)-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]propanamide
CID 18119539
2-(4-methylphenoxy)-N-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]propanamide
CID 24509083
N-[(3-bromophenyl)methyl]-2-(4-methylphenoxy)propanamide
CID 75871684
2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide
CID 53282928
2-(2,6-dimethylphenoxy)-N-[(4-methylphenyl)methyl]propanamide
CID 46761712

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide?
The IUPAC name of 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide (CID 4221032) is 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide is Cc1ccc(CNC(=O)C(C)Oc2ccc(C)cc2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide?
The InChIKey is KOQQXDAXHHWMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-13-4-8-16(9-5-13)12-19-18(20)15(3)21-17-10-6-14(2)7-11-17/h4-11,15H,12H2,1-3H3,(H,19,20).
What are the key properties of 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide?
2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide has a molecular weight of 283.37 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide is sourced from PubChem (CID 4221032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).