2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide

C8H13N3O3 — CID 106417066

IUPAC2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide
SMILESNCCOCC(=O)NCc1ccno1
InChIInChI=1S/C8H13N3O3/c9-2-4-13-6-8(12)10-5-7-1-3-11-14-7/h1,3H,2,4-6,9H2,(H,10,12)
InChIKeyOBIHGRWHPHMJBE-UHFFFAOYSA-N
MW199.21 g/mol
LogP-0.73
Rot. Bonds6

About 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide

2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide (PubChem CID 106417066) has the molecular formula C8H13N3O3 and a molecular weight of 199.21 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide
PubChem CID106417066
Molecular FormulaC8H13N3O3
Molecular Weight199.21 g/mol
Exact Mass199.10
IUPAC Name2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide
SMILESNCCOCC(=O)NCc1ccno1
InChIInChI=1S/C8H13N3O3/c9-2-4-13-6-8(12)10-5-7-1-3-11-14-7/h1,3H,2,4-6,9H2,(H,10,12)
InChIKeyOBIHGRWHPHMJBE-UHFFFAOYSA-N
XLogP-0.73
TPSA90.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.21
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(1,2-oxazol-5-ylmethyl)acetamide
CID 103939766
6-(1,2-oxazol-5-ylmethylamino)-6-oxohexanoic acid
CID 106414801
2-(2-aminoethoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 79464439
2-(2-aminoethoxy)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide
CID 79474047
2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide
CID 104600446
2-(2-aminoethoxy)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]acetamide
CID 106370910
3-amino-4,4-dimethyl-N-(1,2-oxazol-5-ylmethyl)pentanamide
CID 106417021
2-amino-4,5-difluoro-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 114185706
2-(2-aminoethoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 79463391
4-amino-3-fluoro-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 106413498
2-(1,2-oxazol-5-ylmethylamino)acetamide
CID 103605544
1-tert-butyl-3-(1,2-oxazol-5-ylmethyl)urea
CID 106415604

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide (CID 106417066) is 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide is NCCOCC(=O)NCc1ccno1.
What is the InChIKey of 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide?
The InChIKey is OBIHGRWHPHMJBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O3/c9-2-4-13-6-8(12)10-5-7-1-3-11-14-7/h1,3H,2,4-6,9H2,(H,10,12).
What are the key properties of 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide?
2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide has a molecular weight of 199.21 g/mol, XLogP of -0.73, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(1,2-oxazol-5-ylmethyl)acetamide is sourced from PubChem (CID 106417066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).