N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide

C7H10N2O3 — CID 59223456

IUPACN-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide
SMILESCOc1cc(CNC(C)=O)on1
InChIInChI=1S/C7H10N2O3/c1-5(10)8-4-6-3-7(11-2)9-12-6/h3H,4H2,1-2H3,(H,8,10)
InChIKeyGHXUNDDBNDKNRJ-UHFFFAOYSA-N
MW170.17 g/mol
LogP0.32
Rot. Bonds3

About N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide

N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide (PubChem CID 59223456) has the molecular formula C7H10N2O3 and a molecular weight of 170.17 g/mol. Its IUPAC name is N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide
PubChem CID59223456
Molecular FormulaC7H10N2O3
Molecular Weight170.17 g/mol
Exact Mass170.07
IUPAC NameN-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide
SMILESCOc1cc(CNC(C)=O)on1
InChIInChI=1S/C7H10N2O3/c1-5(10)8-4-6-3-7(11-2)9-12-6/h3H,4H2,1-2H3,(H,8,10)
InChIKeyGHXUNDDBNDKNRJ-UHFFFAOYSA-N
XLogP0.32
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-Methoxy-ethyl)-[3-(3-piperidin-1-yl-propoxy)-isoxazol-5-ylmethyl]-amine
CID 11666530
3-Methoxy-5-isoxazolemethanamine
CID 2763227
3-methoxy-N-(3-(2-oxopyrrolidin-1-yl)propyl)isoxazole-5-carboxamide
CID 71802447
3-methoxy-N-(2,2,2-trifluoroethyl)isoxazole-5-carboxamide
CID 71802478
2-ethyl-N-[(3-methoxy-1,2-oxazol-5-yl)methyl]-6-methylmorpholine-4-carboxamide
CID 132314926
3-(3-but-3-ynyldiazirin-3-yl)-N-[(3-methoxy-1,2-oxazol-5-yl)methyl]propanamide
CID 132393159
N'-[[3-(trifluoromethoxy)-1,2-oxazol-5-yl]methyl]ethane-1,2-diamine
CID 70458636
N-(2-Nitroxyethyl)-5-methyl-3-isoxazolyloxyacetamide
CID 15839974
Ethyl 3-[[3-(3-aminopropoxy)-1,2-oxazole-5-carbonyl]amino]propanoate
CID 19707222
4-[(3-Methoxy-1,2-oxazole-5-carbonyl)amino]butanoic acid
CID 20075007
1-N'-[(5-methyl-1,2-oxazol-3-yl)oxymethyl]ethane-1,1-diamine
CID 20589476
(3-Methoxyisoxazol-5-yl)methanamine hydrochloride
CID 21292276

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide?
The IUPAC name of N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide (CID 59223456) is N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide.
What is the SMILES notation for N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide?
The canonical SMILES for N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide is COc1cc(CNC(C)=O)on1.
What is the InChIKey of N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide?
The InChIKey is GHXUNDDBNDKNRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3/c1-5(10)8-4-6-3-7(11-2)9-12-6/h3H,4H2,1-2H3,(H,8,10).
What are the key properties of N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide?
N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide has a molecular weight of 170.17 g/mol, XLogP of 0.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide is sourced from PubChem (CID 59223456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).