N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide

C11H20N4O3 — CID 47022638

IUPACN-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide
SMILESCOCCNC(=O)CN(C)C(C)c1nc(C)no1
InChIInChI=1S/C11H20N4O3/c1-8(11-13-9(2)14-18-11)15(3)7-10(16)12-5-6-17-4/h8H,5-7H2,1-4H3,(H,12,16)
InChIKeyUURMFVWFDKXIMH-UHFFFAOYSA-N
MW256.31 g/mol
LogP0.13
Rot. Bonds7

About N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide

N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide (PubChem CID 47022638) has the molecular formula C11H20N4O3 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide
PubChem CID47022638
Molecular FormulaC11H20N4O3
Molecular Weight256.31 g/mol
Exact Mass256.15
IUPAC NameN-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide
SMILESCOCCNC(=O)CN(C)C(C)c1nc(C)no1
InChIInChI=1S/C11H20N4O3/c1-8(11-13-9(2)14-18-11)15(3)7-10(16)12-5-6-17-4/h8H,5-7H2,1-4H3,(H,12,16)
InChIKeyUURMFVWFDKXIMH-UHFFFAOYSA-N
XLogP0.13
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 50.13
H-Bond Donors ≤ 51
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 N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide (CID 47022638) is N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide is COCCNC(=O)CN(C)C(C)c1nc(C)no1.
What is the InChIKey of N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide?
The InChIKey is UURMFVWFDKXIMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3/c1-8(11-13-9(2)14-18-11)15(3)7-10(16)12-5-6-17-4/h8H,5-7H2,1-4H3,(H,12,16).
What are the key properties of N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide?
N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide has a molecular weight of 256.31 g/mol, XLogP of 0.13, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[methyl-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide is sourced from PubChem (CID 47022638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).