(2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide

C20H23NO3 — CID 9238804

IUPAC(2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide
SMILESCC(=O)c1ccc(NC(=O)[C@H](C)Oc2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C20H23NO3/c1-13(2)16-7-11-19(12-8-16)24-15(4)20(23)21-18-9-5-17(6-10-18)14(3)22/h5-13,15H,1-4H3,(H,21,23)/t15-/m0/s1
InChIKeySOIZXXKZEWRCSI-HNNXBMFYSA-N
MW325.41 g/mol
LogP4.42
Rot. Bonds6

About (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide

(2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide (PubChem CID 9238804) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound Name(2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide
PubChem CID9238804
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC Name(2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide
SMILESCC(=O)c1ccc(NC(=O)[C@H](C)Oc2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C20H23NO3/c1-13(2)16-7-11-19(12-8-16)24-15(4)20(23)21-18-9-5-17(6-10-18)14(3)22/h5-13,15H,1-4H3,(H,21,23)/t15-/m0/s1
InChIKeySOIZXXKZEWRCSI-HNNXBMFYSA-N
XLogP4.42
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 4953600
(2R)-N-(4-acetylphenyl)-2-(4-iodophenoxy)propanamide
CID 1222649
2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 2951611
N-(4-acetylphenyl)-2-[4-(4-chlorobenzoyl)phenoxy]propanamide
CID 4884528
N-ethyl-4-[2-(4-propan-2-ylphenoxy)propanoylamino]benzamide
CID 17234372
N-(4-acetylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 53266489
N-(4-butan-2-yloxyphenyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 17160633
(2R)-2-(4-acetylphenoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 7763890
N-(4-propan-2-ylphenyl)-2-(4-propylphenoxy)propanamide
CID 53266150
methyl 4-[(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl]oxybenzoate
CID 7965103
N-(4-acetamidophenyl)-2-(4-chlorophenoxy)propanamide
CID 4943851
2-(4-acetylphenoxy)-N-(4-phenylmethoxyphenyl)propanamide
CID 4879204

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide?
The IUPAC name of (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide (CID 9238804) is (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide?
The canonical SMILES for (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide is CC(=O)c1ccc(NC(=O)[C@H](C)Oc2ccc(C(C)C)cc2)cc1.
What is the InChIKey of (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide?
The InChIKey is SOIZXXKZEWRCSI-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H23NO3/c1-13(2)16-7-11-19(12-8-16)24-15(4)20(23)21-18-9-5-17(6-10-18)14(3)22/h5-13,15H,1-4H3,(H,21,23)/t15-/m0/s1.
What are the key properties of (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide?
(2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide has a molecular weight of 325.41 g/mol, XLogP of 4.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(4-acetylphenyl)-2-(4-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 9238804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).