2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide

C20H25NO2 — CID 4944710

IUPAC2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)C(C)Oc2cc(C)ccc2C)c(C)c1
InChIInChI=1S/C20H25NO2/c1-12-7-8-14(3)18(11-12)23-17(6)20(22)21-19-15(4)9-13(2)10-16(19)5/h7-11,17H,1-6H3,(H,21,22)
InChIKeyAIMSDLJFEMEJOH-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.63
Rot. Bonds4

About 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide

2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide (PubChem CID 4944710) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
PubChem CID4944710
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)C(C)Oc2cc(C)ccc2C)c(C)c1
InChIInChI=1S/C20H25NO2/c1-12-7-8-14(3)18(11-12)23-17(6)20(22)21-19-15(4)9-13(2)10-16(19)5/h7-11,17H,1-6H3,(H,21,22)
InChIKeyAIMSDLJFEMEJOH-UHFFFAOYSA-N
XLogP4.63
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(2,4-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 837680
(2R)-2-(2,4-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 837681
2-(2,5-dimethylphenoxy)-N-[4-[2-(2,5-dimethylphenoxy)propanoylamino]phenyl]propanamide
CID 4945097
(2R)-2-[2-iodo-5-methyl-3-[(2R)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl]oxyphenoxy]-N-(2,4,6-trimethylphenyl)propanamide
CID 52916896
N-(4-acetamidophenyl)-2-(2,5-dimethylphenoxy)propanamide
CID 4944630
(2R)-2-(2,5-dimethylphenoxy)-N-phenylpropanamide
CID 7379538
2-(2,5-dimethylphenoxy)-N-[4-[4-[2-(2,5-dimethylphenoxy)propanoylamino]phenoxy]phenyl]propanamide
CID 4945102
2-(3,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 53266252
(2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
CID 40771491
2-(2,5-dimethylphenoxy)-N-[6-[2-(2,5-dimethylphenoxy)propanoylamino]hexyl]propanamide
CID 4945104
N-[4-(dimethylamino)phenyl]-2-(2,5-dimethylphenoxy)propanamide
CID 53266988
2-(2,4-dimethylphenoxy)-N-(3,5-dimethylphenyl)propanamide
CID 6916117

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide?
The IUPAC name of 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide (CID 4944710) is 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide.
What is the SMILES notation for 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide?
The canonical SMILES for 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide is Cc1cc(C)c(NC(=O)C(C)Oc2cc(C)ccc2C)c(C)c1.
What is the InChIKey of 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide?
The InChIKey is AIMSDLJFEMEJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-12-7-8-14(3)18(11-12)23-17(6)20(22)21-19-15(4)9-13(2)10-16(19)5/h7-11,17H,1-6H3,(H,21,22).
What are the key properties of 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide?
2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide has a molecular weight of 311.43 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide is sourced from PubChem (CID 4944710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).