(2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide

C14H16N2O3 — CID 27233380

IUPAC(2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide
SMILESCC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccon1
InChIInChI=1S/C14H16N2O3/c1-3-12(14(17)15-13-8-9-18-16-13)19-11-6-4-10(2)5-7-11/h4-9,12H,3H2,1-2H3,(H,15,16,17)/t12-/m1/s1
InChIKeyQPHHADIQYVWMFT-GFCCVEGCSA-N
MW260.29 g/mol
LogP2.78
Rot. Bonds5

About (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide

(2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide (PubChem CID 27233380) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide.

Molecular Properties

Compound Name(2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide
PubChem CID27233380
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name(2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide
SMILESCC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccon1
InChIInChI=1S/C14H16N2O3/c1-3-12(14(17)15-13-8-9-18-16-13)19-11-6-4-10(2)5-7-11/h4-9,12H,3H2,1-2H3,(H,15,16,17)/t12-/m1/s1
InChIKeyQPHHADIQYVWMFT-GFCCVEGCSA-N
XLogP2.78
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluorophenoxy)-N-(1,2-oxazol-3-yl)butanamide
CID 17249225
(2S)-2-(4-chloro-3-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide
CID 27233481
N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(4-methylphenyl)phenoxy]butanamide
CID 24533971
(2S)-2-(4-methylphenoxy)-N-[2-[[(2S)-2-(4-methylphenoxy)butanoyl]amino]ethyl]butanamide
CID 40796762
(2R)-N-methyl-2-(4-methylphenoxy)butanamide
CID 40742854
(2R)-N-(1,2-oxazol-3-yl)-2-(4-propan-2-ylphenoxy)propanamide
CID 42562865
2-(4-methylphenoxy)-N-(2,4,6-trimethylphenyl)butanamide
CID 4949931
2-(4-butan-2-ylphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)butanamide
CID 24533965
N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide
CID 53286287
N-(3-acetylphenyl)-2-(4-methylphenoxy)butanamide
CID 4949978
(2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide
CID 40775968
N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2-(4-methylphenoxy)butanamide
CID 3163982

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide?
The IUPAC name of (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide (CID 27233380) is (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide.
What is the SMILES notation for (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide?
The canonical SMILES for (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide is CC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccon1.
What is the InChIKey of (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide?
The InChIKey is QPHHADIQYVWMFT-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-3-12(14(17)15-13-8-9-18-16-13)19-11-6-4-10(2)5-7-11/h4-9,12H,3H2,1-2H3,(H,15,16,17)/t12-/m1/s1.
What are the key properties of (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide?
(2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide has a molecular weight of 260.29 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide is sourced from PubChem (CID 27233380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).