2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide

C14H18N4O3 — CID 119741042

IUPAC2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide
SMILESCOCCNCC(=O)Nc1cccc(-c2noc(C)n2)c1
InChIInChI=1S/C14H18N4O3/c1-10-16-14(18-21-10)11-4-3-5-12(8-11)17-13(19)9-15-6-7-20-2/h3-5,8,15H,6-7,9H2,1-2H3,(H,17,19)
InChIKeySNLWYPYFKOWXQO-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.22
Rot. Bonds7

About 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide

2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide (PubChem CID 119741042) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide
PubChem CID119741042
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide
SMILESCOCCNCC(=O)Nc1cccc(-c2noc(C)n2)c1
InChIInChI=1S/C14H18N4O3/c1-10-16-14(18-21-10)11-4-3-5-12(8-11)17-13(19)9-15-6-7-20-2/h3-5,8,15H,6-7,9H2,1-2H3,(H,17,19)
InChIKeySNLWYPYFKOWXQO-UHFFFAOYSA-N
XLogP1.22
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide (CID 119741042) is 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide is COCCNCC(=O)Nc1cccc(-c2noc(C)n2)c1.
What is the InChIKey of 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide?
The InChIKey is SNLWYPYFKOWXQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-10-16-14(18-21-10)11-4-3-5-12(8-11)17-13(19)9-15-6-7-20-2/h3-5,8,15H,6-7,9H2,1-2H3,(H,17,19).
What are the key properties of 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide?
2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide has a molecular weight of 290.32 g/mol, XLogP of 1.22, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide is sourced from PubChem (CID 119741042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).