2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide

C15H19N3O3 — CID 79224343

IUPAC2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide
SMILESCc1noc(C)c1C(C)NC(=O)COc1ccccc1N
InChIInChI=1S/C15H19N3O3/c1-9(15-10(2)18-21-11(15)3)17-14(19)8-20-13-7-5-4-6-12(13)16/h4-7,9H,8,16H2,1-3H3,(H,17,19)
InChIKeyMFDNSCYHOXAKPJ-UHFFFAOYSA-N
MW289.33 g/mol
LogP2.13
Rot. Bonds5

About 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide

2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide (PubChem CID 79224343) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide
PubChem CID79224343
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide
SMILESCc1noc(C)c1C(C)NC(=O)COc1ccccc1N
InChIInChI=1S/C15H19N3O3/c1-9(15-10(2)18-21-11(15)3)17-14(19)8-20-13-7-5-4-6-12(13)16/h4-7,9H,8,16H2,1-3H3,(H,17,19)
InChIKeyMFDNSCYHOXAKPJ-UHFFFAOYSA-N
XLogP2.13
TPSA90.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzamide
CID 79225808
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 78961689
2-(2-aminophenoxy)-N-(1-thiophen-3-ylethyl)acetamide
CID 62840774
2-(2-aminophenoxy)-N-hexan-2-ylacetamide
CID 62197710
2-(2-aminophenoxy)-N-ethylacetamide
CID 16776803
3-chloro-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]propanamide
CID 79237007
3-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-[1-(2-methoxyphenyl)propan-2-yl]-1-methylurea
CID 71869863
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-sulfanylbenzamide
CID 107032001
7-amino-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]heptanamide
CID 79235967
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-(propan-2-ylamino)propanamide
CID 79236273
2-(2-aminophenoxy)-N-(2-methyl-3-pyridinyl)acetamide
CID 79042181
2-(2-ethylphenoxy)-N-[(1R)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]acetamide
CID 94820638

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide?
The IUPAC name of 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide (CID 79224343) is 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide is Cc1noc(C)c1C(C)NC(=O)COc1ccccc1N.
What is the InChIKey of 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide?
The InChIKey is MFDNSCYHOXAKPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-9(15-10(2)18-21-11(15)3)17-14(19)8-20-13-7-5-4-6-12(13)16/h4-7,9H,8,16H2,1-3H3,(H,17,19).
What are the key properties of 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide?
2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide has a molecular weight of 289.33 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenoxy)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide is sourced from PubChem (CID 79224343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).