2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide

C14H16N2O3 — CID 17249224

IUPAC2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide
SMILESCc1cccc(OC(C)C(=O)Nc2ccon2)c1C
InChIInChI=1S/C14H16N2O3/c1-9-5-4-6-12(10(9)2)19-11(3)14(17)15-13-7-8-18-16-13/h4-8,11H,1-3H3,(H,15,16,17)
InChIKeyVZMWCDQWHSLLNE-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.70
Rot. Bonds4

About 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide

2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide (PubChem CID 17249224) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide.

Molecular Properties

Compound Name2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide
PubChem CID17249224
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide
SMILESCc1cccc(OC(C)C(=O)Nc2ccon2)c1C
InChIInChI=1S/C14H16N2O3/c1-9-5-4-6-12(10(9)2)19-11(3)14(17)15-13-7-8-18-16-13/h4-8,11H,1-3H3,(H,15,16,17)
InChIKeyVZMWCDQWHSLLNE-UHFFFAOYSA-N
XLogP2.70
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide
CID 42561678
(2S)-N-(1,2-oxazol-3-yl)-2-(2-propan-2-ylphenoxy)propanamide
CID 42562928
(2S)-2-(2,3-dimethylphenoxy)-N-(2,3-dimethylphenyl)propanamide
CID 28574303
2-(2,3-dimethylphenoxy)-N-phenylpropanamide
CID 43909351
(2S)-2-(2,3-dimethylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide
CID 38013113
N-(2,6-difluorophenyl)-2-(2,3-dimethylphenoxy)propanamide
CID 43915329
(2R)-2-(2,3-dimethylphenoxy)-N-(4-phenyl-1,2,5-oxadiazol-3-yl)propanamide
CID 40871308
(2R)-N-(1,2-oxazol-3-yl)-2-(4-propan-2-ylphenoxy)propanamide
CID 42562865
2-(2,3-dimethylphenoxy)-N-pyridin-3-ylpropanamide
CID 43875980
(2S)-N-(2-bromophenyl)-2-(2,3-dimethylphenoxy)propanamide
CID 891226
(2S)-N-(2-cyanophenyl)-2-(2,3-dimethylphenoxy)propanamide
CID 7668733
(2S)-N-(1,3-benzodioxol-5-yl)-2-(2,3-dimethylphenoxy)propanamide
CID 30384284

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide?
The IUPAC name of 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide (CID 17249224) is 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide.
What is the SMILES notation for 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide?
The canonical SMILES for 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide is Cc1cccc(OC(C)C(=O)Nc2ccon2)c1C.
What is the InChIKey of 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide?
The InChIKey is VZMWCDQWHSLLNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-9-5-4-6-12(10(9)2)19-11(3)14(17)15-13-7-8-18-16-13/h4-8,11H,1-3H3,(H,15,16,17).
What are the key properties of 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide?
2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide has a molecular weight of 260.29 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide is sourced from PubChem (CID 17249224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).