(2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide

C19H23NO2 — CID 93488050

IUPAC(2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide
SMILESCC[C@@H](Oc1cc(C)ccc1C)C(=O)Nc1cccc(C)c1
InChIInChI=1S/C19H23NO2/c1-5-17(22-18-12-14(3)9-10-15(18)4)19(21)20-16-8-6-7-13(2)11-16/h6-12,17H,5H2,1-4H3,(H,20,21)/t17-/m1/s1
InChIKeyFJWLJVUWNXCVLW-QGZVFWFLSA-N
MW297.40 g/mol
LogP4.41
Rot. Bonds5

About (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide

(2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide (PubChem CID 93488050) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide.

Molecular Properties

Compound Name(2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide
PubChem CID93488050
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name(2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide
SMILESCC[C@@H](Oc1cc(C)ccc1C)C(=O)Nc1cccc(C)c1
InChIInChI=1S/C19H23NO2/c1-5-17(22-18-12-14(3)9-10-15(18)4)19(21)20-16-8-6-7-13(2)11-16/h6-12,17H,5H2,1-4H3,(H,20,21)/t17-/m1/s1
InChIKeyFJWLJVUWNXCVLW-QGZVFWFLSA-N
XLogP4.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(3-chlorophenyl)-2-(2,5-dimethylphenoxy)butanamide
CID 92681805
(2R)-2-(2,5-dimethylphenoxy)-N-(3,5-dimethylphenyl)butanamide
CID 92646353
(2S)-2-(2,5-dimethylphenoxy)-N-(3-prop-2-enoxyphenyl)butanamide
CID 99949902
(2S)-2-(2,5-dimethylphenoxy)-N-[(3-methylphenyl)methyl]butanamide
CID 92682902
2-(2,5-dimethylphenoxy)butanehydrazide
CID 54792983
(2R)-2-(2,4-dimethylphenoxy)-N-(3,4-dimethylphenyl)butanamide
CID 99133094
N-(2-chlorophenyl)-2-(2,5-dimethylphenoxy)butanamide
CID 132760463
2-(2,4-dimethylphenoxy)-N-(3-methylsulfanylphenyl)butanamide
CID 132651398
ethyl 2-chloro-4-[[(2R)-2-(2,5-dimethylphenoxy)butanoyl]amino]benzoate
CID 28636858
(2R)-2-(2,5-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)butanamide
CID 28635073
(2S)-2-(3-chlorophenoxy)-N-(3-methylphenyl)butanamide
CID 92671807
2-(4-fluorophenoxy)-N-(3-methylphenyl)butanamide
CID 53284409

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide?
The IUPAC name of (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide (CID 93488050) is (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide.
What is the SMILES notation for (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide?
The canonical SMILES for (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide is CC[C@@H](Oc1cc(C)ccc1C)C(=O)Nc1cccc(C)c1.
What is the InChIKey of (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide?
The InChIKey is FJWLJVUWNXCVLW-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H23NO2/c1-5-17(22-18-12-14(3)9-10-15(18)4)19(21)20-16-8-6-7-13(2)11-16/h6-12,17H,5H2,1-4H3,(H,20,21)/t17-/m1/s1.
What are the key properties of (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide?
(2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide has a molecular weight of 297.40 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,5-dimethylphenoxy)-N-(3-methylphenyl)butanamide is sourced from PubChem (CID 93488050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).